3-acetamido-N-(2-cyclopropyl-1-methylbenzimidazol-5-yl)benzamide

C20H20N4O2 — CID 110793284

IUPAC3-acetamido-N-(2-cyclopropyl-1-methylbenzimidazol-5-yl)benzamide
SMILESCC(=O)Nc1cccc(C(=O)Nc2ccc3c(c2)nc(C2CC2)n3C)c1
InChIInChI=1S/C20H20N4O2/c1-12(25)21-15-5-3-4-14(10-15)20(26)22-16-8-9-18-17(11-16)23-19(24(18)2)13-6-7-13/h3-5,8-11,13H,6-7H2,1-2H3,(H,21,25)(H,22,26)
InChIKeyZRTUMDKVCDVFDX-UHFFFAOYSA-N
MW348.41 g/mol
LogP3.66
Rot. Bonds4

About 3-acetamido-N-(2-cyclopropyl-1-methylbenzimidazol-5-yl)benzamide

3-acetamido-N-(2-cyclopropyl-1-methylbenzimidazol-5-yl)benzamide (PubChem CID 110793284) has the molecular formula C20H20N4O2 and a molecular weight of 348.41 g/mol. Its IUPAC name is 3-acetamido-N-(2-cyclopropyl-1-methylbenzimidazol-5-yl)benzamide.

Molecular Properties

Compound Name3-acetamido-N-(2-cyclopropyl-1-methylbenzimidazol-5-yl)benzamide
PubChem CID110793284
Molecular FormulaC20H20N4O2
Molecular Weight348.41 g/mol
Exact Mass348.16
IUPAC Name3-acetamido-N-(2-cyclopropyl-1-methylbenzimidazol-5-yl)benzamide
SMILESCC(=O)Nc1cccc(C(=O)Nc2ccc3c(c2)nc(C2CC2)n3C)c1
InChIInChI=1S/C20H20N4O2/c1-12(25)21-15-5-3-4-14(10-15)20(26)22-16-8-9-18-17(11-16)23-19(24(18)2)13-6-7-13/h3-5,8-11,13H,6-7H2,1-2H3,(H,21,25)(H,22,26)
InChIKeyZRTUMDKVCDVFDX-UHFFFAOYSA-N
XLogP3.66
TPSA76.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.41
LogP ≤ 53.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 3-acetamido-N-(2-cyclopropyl-1-methylbenzimidazol-5-yl)benzamide 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-(2-cyclopropyl-1-methylbenzimidazol-5-yl)-1H-pyrrole-2-carboxamide
CID 75393659
N-(2-cyclopropyl-1-methylbenzimidazol-5-yl)-1,3-thiazole-4-carboxamide
CID 97084171
N-(2-cyclopropyl-1-methylbenzimidazol-5-yl)-2-methylfuran-3-carboxamide
CID 75392652
N,2-dicyclopropyl-1-methylbenzimidazole-5-carboxamide
CID 110765996
N-(2-cyclopropyl-1-methylbenzimidazol-5-yl)-5-methyl-1,3-oxazole-4-carboxamide
CID 75392653
N-[3-(cyclopropylcarbamoyl)phenyl]-1,2-dimethylbenzimidazole-5-carboxamide
CID 71881118
2-(5-acetyl-2-methoxyphenyl)-N-(2-cyclopropyl-1-methylbenzimidazol-5-yl)acetamide
CID 71907055
N-(3-acetamidophenyl)-2-ethyl-1-methylbenzimidazole-5-carboxamide
CID 100776792
9-amino-N-(2-cyclopropyl-1-methylbenzimidazol-5-yl)bicyclo[3.3.1]nonane-3-carboxamide
CID 120993673
3-acetamido-N-(1-methyl-2-oxo-3H-benzimidazol-5-yl)benzamide
CID 110743522
4-(2-cyclopropyl-1-methylbenzimidazol-5-yl)butan-2-one
CID 82497246
(2R,3S)-N-(2-cyclopropyl-1-methylbenzimidazol-5-yl)-2-methylmorpholine-3-carboxamide
CID 166238515

Frequently Asked Questions

What is the IUPAC name of 3-acetamido-N-(2-cyclopropyl-1-methylbenzimidazol-5-yl)benzamide?
The IUPAC name of 3-acetamido-N-(2-cyclopropyl-1-methylbenzimidazol-5-yl)benzamide (CID 110793284) is 3-acetamido-N-(2-cyclopropyl-1-methylbenzimidazol-5-yl)benzamide.
What is the SMILES notation for 3-acetamido-N-(2-cyclopropyl-1-methylbenzimidazol-5-yl)benzamide?
The canonical SMILES for 3-acetamido-N-(2-cyclopropyl-1-methylbenzimidazol-5-yl)benzamide is CC(=O)Nc1cccc(C(=O)Nc2ccc3c(c2)nc(C2CC2)n3C)c1.
What is the InChIKey of 3-acetamido-N-(2-cyclopropyl-1-methylbenzimidazol-5-yl)benzamide?
The InChIKey is ZRTUMDKVCDVFDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N4O2/c1-12(25)21-15-5-3-4-14(10-15)20(26)22-16-8-9-18-17(11-16)23-19(24(18)2)13-6-7-13/h3-5,8-11,13H,6-7H2,1-2H3,(H,21,25)(H,22,26).
What are the key properties of 3-acetamido-N-(2-cyclopropyl-1-methylbenzimidazol-5-yl)benzamide?
3-acetamido-N-(2-cyclopropyl-1-methylbenzimidazol-5-yl)benzamide has a molecular weight of 348.41 g/mol, XLogP of 3.66, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-acetamido-N-(2-cyclopropyl-1-methylbenzimidazol-5-yl)benzamide is sourced from PubChem (CID 110793284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).