N-[[3-(2-acetamido-3H-benzimidazol-5-yl)phenyl]methyl]benzamide

C23H20N4O2 — CID 175436695

IUPACN-[[3-(2-acetamido-3H-benzimidazol-5-yl)phenyl]methyl]benzamide
SMILESCC(=O)Nc1nc2ccc(-c3cccc(CNC(=O)c4ccccc4)c3)cc2[nH]1
InChIInChI=1S/C23H20N4O2/c1-15(28)25-23-26-20-11-10-19(13-21(20)27-23)18-9-5-6-16(12-18)14-24-22(29)17-7-3-2-4-8-17/h2-13H,14H2,1H3,(H,24,29)(H2,25,26,27,28)
InChIKeyXKHSNUIKGUOQIB-UHFFFAOYSA-N
MW384.44 g/mol
LogP4.12
Rot. Bonds5

About N-[[3-(2-acetamido-3H-benzimidazol-5-yl)phenyl]methyl]benzamide

N-[[3-(2-acetamido-3H-benzimidazol-5-yl)phenyl]methyl]benzamide (PubChem CID 175436695) has the molecular formula C23H20N4O2 and a molecular weight of 384.44 g/mol. Its IUPAC name is N-[[3-(2-acetamido-3H-benzimidazol-5-yl)phenyl]methyl]benzamide.

Molecular Properties

Compound NameN-[[3-(2-acetamido-3H-benzimidazol-5-yl)phenyl]methyl]benzamide
PubChem CID175436695
Molecular FormulaC23H20N4O2
Molecular Weight384.44 g/mol
Exact Mass384.16
IUPAC NameN-[[3-(2-acetamido-3H-benzimidazol-5-yl)phenyl]methyl]benzamide
SMILESCC(=O)Nc1nc2ccc(-c3cccc(CNC(=O)c4ccccc4)c3)cc2[nH]1
InChIInChI=1S/C23H20N4O2/c1-15(28)25-23-26-20-11-10-19(13-21(20)27-23)18-9-5-6-16(12-18)14-24-22(29)17-7-3-2-4-8-17/h2-13H,14H2,1H3,(H,24,29)(H2,25,26,27,28)
InChIKeyXKHSNUIKGUOQIB-UHFFFAOYSA-N
XLogP4.12
TPSA86.88 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.44
LogP ≤ 54.12
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze N-[[3-(2-acetamido-3H-benzimidazol-5-yl)phenyl]methyl]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-propan-2-yl-3H-benzimidazol-5-yl)methyl]benzamide
CID 110785727
N-[6-[6-(5-phenyl-1H-benzimidazol-2-yl)-1H-benzimidazol-2-yl]-1H-benzimidazol-2-yl]benzamide
CID 177417109
3-[[(4-phenylbenzoyl)amino]methyl]benzoic acid
CID 108767634
N-[6-(1H-pyrazol-5-yl)-1H-benzimidazol-2-yl]benzamide
CID 166431499
N-(3-methylbutyl)-3-[2-[[4-(trifluoromethyl)benzoyl]amino]-3H-benzimidazol-5-yl]benzamide
CID 168873259
N-[[3-[4-(1,3-dioxol-2-yl)phenyl]phenyl]methyl]benzamide
CID 141050517
prop-2-ynyl N-(6-phenyl-1H-benzimidazol-2-yl)carbamate
CID 21366127
3-(benzamidomethyl)benzoic acid;ethane
CID 90875099
N-benzyl-2-(4-phenoxyphenyl)-3H-benzimidazole-5-carboxamide
CID 71717004
N-[(6-methyl-1H-benzimidazol-2-yl)methyl]benzamide
CID 924710
N-(2-acetamidoethyl)-2-phenyl-3H-benzimidazole-5-carboxamide
CID 110766096
N-benzyl-3-[(4-phenylbenzoyl)amino]benzamide
CID 28638755

Frequently Asked Questions

What is the IUPAC name of N-[[3-(2-acetamido-3H-benzimidazol-5-yl)phenyl]methyl]benzamide?
The IUPAC name of N-[[3-(2-acetamido-3H-benzimidazol-5-yl)phenyl]methyl]benzamide (CID 175436695) is N-[[3-(2-acetamido-3H-benzimidazol-5-yl)phenyl]methyl]benzamide.
What is the SMILES notation for N-[[3-(2-acetamido-3H-benzimidazol-5-yl)phenyl]methyl]benzamide?
The canonical SMILES for N-[[3-(2-acetamido-3H-benzimidazol-5-yl)phenyl]methyl]benzamide is CC(=O)Nc1nc2ccc(-c3cccc(CNC(=O)c4ccccc4)c3)cc2[nH]1.
What is the InChIKey of N-[[3-(2-acetamido-3H-benzimidazol-5-yl)phenyl]methyl]benzamide?
The InChIKey is XKHSNUIKGUOQIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N4O2/c1-15(28)25-23-26-20-11-10-19(13-21(20)27-23)18-9-5-6-16(12-18)14-24-22(29)17-7-3-2-4-8-17/h2-13H,14H2,1H3,(H,24,29)(H2,25,26,27,28).
What are the key properties of N-[[3-(2-acetamido-3H-benzimidazol-5-yl)phenyl]methyl]benzamide?
N-[[3-(2-acetamido-3H-benzimidazol-5-yl)phenyl]methyl]benzamide has a molecular weight of 384.44 g/mol, XLogP of 4.12, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-(2-acetamido-3H-benzimidazol-5-yl)phenyl]methyl]benzamide is sourced from PubChem (CID 175436695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).