1-benzoyl-N,N-diethylbenzimidazole-2-carboxamide

C19H19N3O2 — CID 23945501

IUPAC1-benzoyl-N,N-diethylbenzimidazole-2-carboxamide
SMILESCCN(CC)C(=O)c1nc2ccccc2n1C(=O)c1ccccc1
InChIInChI=1S/C19H19N3O2/c1-3-21(4-2)19(24)17-20-15-12-8-9-13-16(15)22(17)18(23)14-10-6-5-7-11-14/h5-13H,3-4H2,1-2H3
InChIKeyMYYHAYHPCXNRGJ-UHFFFAOYSA-N
MW321.38 g/mol
LogP3.21
Rot. Bonds4

About 1-benzoyl-N,N-diethylbenzimidazole-2-carboxamide

1-benzoyl-N,N-diethylbenzimidazole-2-carboxamide (PubChem CID 23945501) has the molecular formula C19H19N3O2 and a molecular weight of 321.38 g/mol. Its IUPAC name is 1-benzoyl-N,N-diethylbenzimidazole-2-carboxamide.

Molecular Properties

Compound Name1-benzoyl-N,N-diethylbenzimidazole-2-carboxamide
PubChem CID23945501
Molecular FormulaC19H19N3O2
Molecular Weight321.38 g/mol
Exact Mass321.15
IUPAC Name1-benzoyl-N,N-diethylbenzimidazole-2-carboxamide
SMILESCCN(CC)C(=O)c1nc2ccccc2n1C(=O)c1ccccc1
InChIInChI=1S/C19H19N3O2/c1-3-21(4-2)19(24)17-20-15-12-8-9-13-16(15)22(17)18(23)14-10-6-5-7-11-14/h5-13H,3-4H2,1-2H3
InChIKeyMYYHAYHPCXNRGJ-UHFFFAOYSA-N
XLogP3.21
TPSA55.20 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.38
LogP ≤ 53.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-benzoyl-N,N-diethylbenzimidazole-2-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

(1-ethylbenzimidazol-2-yl)-phenylmethanone
CID 67579558
1-[1-(pyridine-3-carbonyl)benzimidazol-2-yl]ethanone
CID 19256635
(2-ethylbenzimidazol-1-yl)-(4-methylphenyl)methanone
CID 177379362
[(1S)-1-(1-benzoylbenzimidazol-2-yl)ethyl] acetate
CID 23582949
CID 174412487
CID 174412487
[2-[6-(1-benzoylbenzimidazol-2-yl)-2-pyridinyl]benzimidazol-1-yl]-phenylmethanone;vanadium;trichloride
CID 173243678
1-(2-acetylbenzimidazol-1-yl)-2-(diethylamino)propan-1-one
CID 19256735
N-[(1R)-1-(1-benzoylbenzimidazol-2-yl)ethyl]benzamide
CID 71482011
1-(2-ethylbenzimidazol-1-yl)ethanone
CID 45078254
bis(1-ethylbenzimidazol-2-yl)methanone
CID 22887473
1-(2-diethylphosphanylbenzimidazol-1-yl)ethanone
CID 122452577
(2-benzylbenzimidazol-1-yl)-(4-hydroxyphenyl)methanone
CID 23766408

Frequently Asked Questions

What is the IUPAC name of 1-benzoyl-N,N-diethylbenzimidazole-2-carboxamide?
The IUPAC name of 1-benzoyl-N,N-diethylbenzimidazole-2-carboxamide (CID 23945501) is 1-benzoyl-N,N-diethylbenzimidazole-2-carboxamide.
What is the SMILES notation for 1-benzoyl-N,N-diethylbenzimidazole-2-carboxamide?
The canonical SMILES for 1-benzoyl-N,N-diethylbenzimidazole-2-carboxamide is CCN(CC)C(=O)c1nc2ccccc2n1C(=O)c1ccccc1.
What is the InChIKey of 1-benzoyl-N,N-diethylbenzimidazole-2-carboxamide?
The InChIKey is MYYHAYHPCXNRGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O2/c1-3-21(4-2)19(24)17-20-15-12-8-9-13-16(15)22(17)18(23)14-10-6-5-7-11-14/h5-13H,3-4H2,1-2H3.
What are the key properties of 1-benzoyl-N,N-diethylbenzimidazole-2-carboxamide?
1-benzoyl-N,N-diethylbenzimidazole-2-carboxamide has a molecular weight of 321.38 g/mol, XLogP of 3.21, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzoyl-N,N-diethylbenzimidazole-2-carboxamide is sourced from PubChem (CID 23945501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).