Input interpretation
dibucaine hydrochloride | 2-amino-3, 5-dichloropyridine
Chemical names and formulas
![| dibucaine hydrochloride | 2-amino-3, 5-dichloropyridine formula | C_20H_30N_3O_2Cl_1 | C_5H_4Cl_2N_2 Hill formula | C_20H_30ClN_3O_2 | C_5H_4Cl_2N_2 name | dibucaine hydrochloride | 2-amino-3, 5-dichloropyridine IUPAC name | 2-[(2-butoxyquinoline-4-carbonyl)amino]ethyl-diethyl-azanium chloride | 3, 5-dichloro-2-pyridinamine alternate names | benzolin | cinchocaine hydrochloride | dibucaine | percaine | (3, 5-dichloro-2-pyridyl)amine | 3, 5-dichloropyridin-2-amine mass fractions | C (carbon) 63.2% | Cl (chlorine) 9.33% | H (hydrogen) 7.96% | N (nitrogen) 11.1% | O (oxygen) 8.42% | C (carbon) 36.8% | Cl (chlorine) 43.5% | H (hydrogen) 2.47% | N (nitrogen) 17.2%](../image_source/98ecc57b13f7df23621d0235ce1615d7.png)
| dibucaine hydrochloride | 2-amino-3, 5-dichloropyridine formula | C_20H_30N_3O_2Cl_1 | C_5H_4Cl_2N_2 Hill formula | C_20H_30ClN_3O_2 | C_5H_4Cl_2N_2 name | dibucaine hydrochloride | 2-amino-3, 5-dichloropyridine IUPAC name | 2-[(2-butoxyquinoline-4-carbonyl)amino]ethyl-diethyl-azanium chloride | 3, 5-dichloro-2-pyridinamine alternate names | benzolin | cinchocaine hydrochloride | dibucaine | percaine | (3, 5-dichloro-2-pyridyl)amine | 3, 5-dichloropyridin-2-amine mass fractions | C (carbon) 63.2% | Cl (chlorine) 9.33% | H (hydrogen) 7.96% | N (nitrogen) 11.1% | O (oxygen) 8.42% | C (carbon) 36.8% | Cl (chlorine) 43.5% | H (hydrogen) 2.47% | N (nitrogen) 17.2%
Structure diagrams
| dibucaine hydrochloride | 2-amino-3, 5-dichloropyridine vertex count | 26 | 9 edge count | 28 | 11 Schultz index | 6680 | 357 Wiener index | 1654 | 84 Hosoya index | 148836 | 56 Balaban index | 1.867 | 2.346
3D structure
3D structure
Basic properties
| dibucaine hydrochloride | 2-amino-3, 5-dichloropyridine molar mass | 379.93 g/mol | 163 g/mol phase | solid (at STP) | solid (at STP) melting point | 97 °C | 82 °C
Units
Hydrophobicity and permeability properties
| dibucaine hydrochloride experimental LogP hydrophobicity | 4.2 predicted LogP hydrophobicity | 3.79 experimental LogS | -3.7 predicted LogS | -3.95
Drug interactions
dibucaine hydrochloride | acenocoumarol | lithium | D-methotrexate (total: 3)
Solid properties (at STP)
| dibucaine hydrochloride refractive index | 1.5502
Chemical identifiers
CC.[Cl-] | C1=C(C=NC(=C1Cl)N)Cl InChI identifier | InChI=1/C20H29N3O2.ClH/c1-4-7-14-25-19-15-17(16-10-8-9-11-18(16)22-19)20(24)21-12-13-23(5-2)6-3;/h8-11, 15H, 4-7, 12-14H2, 1-3H3, (H, 21, 24);1H/fC20H30N3O2.Cl/h21, 23H;1h/q+1;-1 | InChI=1/C5H4Cl2N2/c6-3-1-4(7)5(8)9-2-3/h1-2H, (H2, 8, 9)/f/h8H2 InChI key | PUFQVTATUTYEAL-PKSOQXRJCE | EU number | 200-498-1 | RTECS number | GD3325000 | MDL number | | MFCD00006313](../image_source/cd3456bdb9747668246e2030cb01eec8.png)
| dibucaine hydrochloride | 2-amino-3, 5-dichloropyridine CAS number | 61-12-1 | 4214-74-8 Beilstein number | 3770332 | 119376 PubChem CID number | 6078 | 77886 PubChem SID number | 10081 | 24848245 SMILES identifier | CCCCOC1=NC2=CC=CC=C2C(=C1)C(=O)NCC[NH+](CC)CC.[Cl-] | C1=C(C=NC(=C1Cl)N)Cl InChI identifier | InChI=1/C20H29N3O2.ClH/c1-4-7-14-25-19-15-17(16-10-8-9-11-18(16)22-19)20(24)21-12-13-23(5-2)6-3;/h8-11, 15H, 4-7, 12-14H2, 1-3H3, (H, 21, 24);1H/fC20H30N3O2.Cl/h21, 23H;1h/q+1;-1 | InChI=1/C5H4Cl2N2/c6-3-1-4(7)5(8)9-2-3/h1-2H, (H2, 8, 9)/f/h8H2 InChI key | PUFQVTATUTYEAL-PKSOQXRJCE | EU number | 200-498-1 | RTECS number | GD3325000 | MDL number | | MFCD00006313