4-[[2-(2-ethyl-3H-benzimidazol-5-yl)acetyl]amino]benzamide

C18H18N4O2 — CID 110772780

IUPAC4-[[2-(2-ethyl-3H-benzimidazol-5-yl)acetyl]amino]benzamide
SMILESCCc1nc2ccc(CC(=O)Nc3ccc(C(N)=O)cc3)cc2[nH]1
InChIInChI=1S/C18H18N4O2/c1-2-16-21-14-8-3-11(9-15(14)22-16)10-17(23)20-13-6-4-12(5-7-13)18(19)24/h3-9H,2,10H2,1H3,(H2,19,24)(H,20,23)(H,21,22)
InChIKeyWSUFDNKNAMGFKB-UHFFFAOYSA-N
MW322.37 g/mol
LogP2.41
Rot. Bonds5

About 4-[[2-(2-ethyl-3H-benzimidazol-5-yl)acetyl]amino]benzamide

4-[[2-(2-ethyl-3H-benzimidazol-5-yl)acetyl]amino]benzamide (PubChem CID 110772780) has the molecular formula C18H18N4O2 and a molecular weight of 322.37 g/mol. Its IUPAC name is 4-[[2-(2-ethyl-3H-benzimidazol-5-yl)acetyl]amino]benzamide.

Molecular Properties

Compound Name4-[[2-(2-ethyl-3H-benzimidazol-5-yl)acetyl]amino]benzamide
PubChem CID110772780
Molecular FormulaC18H18N4O2
Molecular Weight322.37 g/mol
Exact Mass322.14
IUPAC Name4-[[2-(2-ethyl-3H-benzimidazol-5-yl)acetyl]amino]benzamide
SMILESCCc1nc2ccc(CC(=O)Nc3ccc(C(N)=O)cc3)cc2[nH]1
InChIInChI=1S/C18H18N4O2/c1-2-16-21-14-8-3-11(9-15(14)22-16)10-17(23)20-13-6-4-12(5-7-13)18(19)24/h3-9H,2,10H2,1H3,(H2,19,24)(H,20,23)(H,21,22)
InChIKeyWSUFDNKNAMGFKB-UHFFFAOYSA-N
XLogP2.41
TPSA100.87 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.37
LogP ≤ 52.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 4-[[2-(2-ethyl-3H-benzimidazol-5-yl)acetyl]amino]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

2-(2-ethyl-3H-benzimidazol-5-yl)-N-phenylacetamide
CID 110772765
N-(3-acetylphenyl)-2-(2-ethyl-3H-benzimidazol-5-yl)acetamide
CID 110772781
N-(4-cyanophenyl)-2-(2-ethyl-3H-benzimidazol-5-yl)acetamide
CID 110772803
N-(3,4-dimethoxyphenyl)-2-(2-ethyl-3H-benzimidazol-5-yl)acetamide
CID 110772778
4-[[2-(2-methyl-1H-indol-5-yl)acetyl]amino]benzamide
CID 110703916
2-(2-ethyl-3H-benzimidazol-5-yl)-N-(pyridin-4-ylmethyl)acetamide
CID 110772732
N-(2-ethyl-3H-benzimidazol-5-yl)-3-(methylamino)propanamide
CID 96675307
2-(4-ethylanilino)-3H-benzimidazole-5-carboxamide
CID 101429158
N-(2-carbamoylphenyl)-2-ethyl-3H-benzimidazole-5-carboxamide
CID 110765583
N-(2-ethyl-3H-benzimidazol-5-yl)-2-(1H-indol-3-yl)acetamide
CID 110793188
1-(2-ethyl-3H-benzimidazol-5-yl)-2-methylpropan-1-one
CID 82493033
4-[[2-(2-oxo-3-propan-2-yl-1H-quinolin-6-yl)acetyl]amino]benzamide
CID 110675556

Frequently Asked Questions

What is the IUPAC name of 4-[[2-(2-ethyl-3H-benzimidazol-5-yl)acetyl]amino]benzamide?
The IUPAC name of 4-[[2-(2-ethyl-3H-benzimidazol-5-yl)acetyl]amino]benzamide (CID 110772780) is 4-[[2-(2-ethyl-3H-benzimidazol-5-yl)acetyl]amino]benzamide.
What is the SMILES notation for 4-[[2-(2-ethyl-3H-benzimidazol-5-yl)acetyl]amino]benzamide?
The canonical SMILES for 4-[[2-(2-ethyl-3H-benzimidazol-5-yl)acetyl]amino]benzamide is CCc1nc2ccc(CC(=O)Nc3ccc(C(N)=O)cc3)cc2[nH]1.
What is the InChIKey of 4-[[2-(2-ethyl-3H-benzimidazol-5-yl)acetyl]amino]benzamide?
The InChIKey is WSUFDNKNAMGFKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N4O2/c1-2-16-21-14-8-3-11(9-15(14)22-16)10-17(23)20-13-6-4-12(5-7-13)18(19)24/h3-9H,2,10H2,1H3,(H2,19,24)(H,20,23)(H,21,22).
What are the key properties of 4-[[2-(2-ethyl-3H-benzimidazol-5-yl)acetyl]amino]benzamide?
4-[[2-(2-ethyl-3H-benzimidazol-5-yl)acetyl]amino]benzamide has a molecular weight of 322.37 g/mol, XLogP of 2.41, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[2-(2-ethyl-3H-benzimidazol-5-yl)acetyl]amino]benzamide is sourced from PubChem (CID 110772780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).