N,N-bis(3-ethylphenyl)benzimidazole-1-carboxamide

C24H23N3O — CID 170699029

IUPACN,N-bis(3-ethylphenyl)benzimidazole-1-carboxamide
SMILESCCc1cccc(N(C(=O)n2cnc3ccccc32)c2cccc(CC)c2)c1
InChIInChI=1S/C24H23N3O/c1-3-18-9-7-11-20(15-18)27(21-12-8-10-19(4-2)16-21)24(28)26-17-25-22-13-5-6-14-23(22)26/h5-17H,3-4H2,1-2H3
InChIKeyXCEBQUUPPCQYMY-UHFFFAOYSA-N
MW369.47 g/mol
LogP5.97
Rot. Bonds4

About N,N-bis(3-ethylphenyl)benzimidazole-1-carboxamide

N,N-bis(3-ethylphenyl)benzimidazole-1-carboxamide (PubChem CID 170699029) has the molecular formula C24H23N3O and a molecular weight of 369.47 g/mol. Its IUPAC name is N,N-bis(3-ethylphenyl)benzimidazole-1-carboxamide.

Molecular Properties

Compound NameN,N-bis(3-ethylphenyl)benzimidazole-1-carboxamide
PubChem CID170699029
Molecular FormulaC24H23N3O
Molecular Weight369.47 g/mol
Exact Mass369.18
IUPAC NameN,N-bis(3-ethylphenyl)benzimidazole-1-carboxamide
SMILESCCc1cccc(N(C(=O)n2cnc3ccccc32)c2cccc(CC)c2)c1
InChIInChI=1S/C24H23N3O/c1-3-18-9-7-11-20(15-18)27(21-12-8-10-19(4-2)16-21)24(28)26-17-25-22-13-5-6-14-23(22)26/h5-17H,3-4H2,1-2H3
InChIKeyXCEBQUUPPCQYMY-UHFFFAOYSA-N
XLogP5.97
TPSA38.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500369.47
LogP ≤ 55.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze N,N-bis(3-ethylphenyl)benzimidazole-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-butyl-N-methylbenzimidazole-1-carboxamide
CID 170699007
N,N-bis(2-methylpropyl)benzimidazole-1-carboxamide
CID 170698971
1-(benzimidazol-1-yl)-3-phenylpropan-1-one
CID 4630006
2-(benzimidazol-1-yl)-1-(3-ethylphenyl)ethanol
CID 105117176
1-(benzimidazol-1-yl)-2-(methylamino)ethanone
CID 110460341
ethyl 3-(benzimidazol-1-yl)-3-(4-ethylphenyl)prop-2-enoate
CID 67351942
N-ethyl-2-(2-ethylindol-1-yl)-N-(3-ethylphenyl)acetamide
CID 174894433
1-(benzimidazol-1-yl)-2-[[2-(benzimidazol-1-yl)-2-oxoethyl]sulfanylmethylsulfanyl]ethanone
CID 3845970
bromomethyl benzimidazole-1-carboxylate
CID 135347541
ethyl 3,3-bis(benzimidazol-1-yl)prop-2-enoate
CID 15564125
2-(benzimidazol-1-yl)-N-benzyl-N-propan-2-ylacetamide
CID 16994989
2-(benzimidazol-1-yl)-N-benzyl-N-tert-butylacetamide
CID 78761759

Frequently Asked Questions

What is the IUPAC name of N,N-bis(3-ethylphenyl)benzimidazole-1-carboxamide?
The IUPAC name of N,N-bis(3-ethylphenyl)benzimidazole-1-carboxamide (CID 170699029) is N,N-bis(3-ethylphenyl)benzimidazole-1-carboxamide.
What is the SMILES notation for N,N-bis(3-ethylphenyl)benzimidazole-1-carboxamide?
The canonical SMILES for N,N-bis(3-ethylphenyl)benzimidazole-1-carboxamide is CCc1cccc(N(C(=O)n2cnc3ccccc32)c2cccc(CC)c2)c1.
What is the InChIKey of N,N-bis(3-ethylphenyl)benzimidazole-1-carboxamide?
The InChIKey is XCEBQUUPPCQYMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N3O/c1-3-18-9-7-11-20(15-18)27(21-12-8-10-19(4-2)16-21)24(28)26-17-25-22-13-5-6-14-23(22)26/h5-17H,3-4H2,1-2H3.
What are the key properties of N,N-bis(3-ethylphenyl)benzimidazole-1-carboxamide?
N,N-bis(3-ethylphenyl)benzimidazole-1-carboxamide has a molecular weight of 369.47 g/mol, XLogP of 5.97, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(3-ethylphenyl)benzimidazole-1-carboxamide is sourced from PubChem (CID 170699029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).