4-(acetamidomethyl)-N-[2-(1H-benzimidazol-2-yl)ethyl]benzamide

C19H20N4O2 — CID 17394585

IUPAC4-(acetamidomethyl)-N-[2-(1H-benzimidazol-2-yl)ethyl]benzamide
SMILESCC(=O)NCc1ccc(C(=O)NCCc2nc3ccccc3[nH]2)cc1
InChIInChI=1S/C19H20N4O2/c1-13(24)21-12-14-6-8-15(9-7-14)19(25)20-11-10-18-22-16-4-2-3-5-17(16)23-18/h2-9H,10-12H2,1H3,(H,20,25)(H,21,24)(H,22,23)
InChIKeyDPQBQMSFFARTSS-UHFFFAOYSA-N
MW336.40 g/mol
LogP2.17
Rot. Bonds6

About 4-(acetamidomethyl)-N-[2-(1H-benzimidazol-2-yl)ethyl]benzamide

4-(acetamidomethyl)-N-[2-(1H-benzimidazol-2-yl)ethyl]benzamide (PubChem CID 17394585) has the molecular formula C19H20N4O2 and a molecular weight of 336.40 g/mol. Its IUPAC name is 4-(acetamidomethyl)-N-[2-(1H-benzimidazol-2-yl)ethyl]benzamide.

Molecular Properties

Compound Name4-(acetamidomethyl)-N-[2-(1H-benzimidazol-2-yl)ethyl]benzamide
PubChem CID17394585
Molecular FormulaC19H20N4O2
Molecular Weight336.40 g/mol
Exact Mass336.16
IUPAC Name4-(acetamidomethyl)-N-[2-(1H-benzimidazol-2-yl)ethyl]benzamide
SMILESCC(=O)NCc1ccc(C(=O)NCCc2nc3ccccc3[nH]2)cc1
InChIInChI=1S/C19H20N4O2/c1-13(24)21-12-14-6-8-15(9-7-14)19(25)20-11-10-18-22-16-4-2-3-5-17(16)23-18/h2-9H,10-12H2,1H3,(H,20,25)(H,21,24)(H,22,23)
InChIKeyDPQBQMSFFARTSS-UHFFFAOYSA-N
XLogP2.17
TPSA86.88 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.40
LogP ≤ 52.17
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 4-(acetamidomethyl)-N-[2-(1H-benzimidazol-2-yl)ethyl]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

4-amino-N-[2-(1H-benzimidazol-2-yl)ethyl]benzamide
CID 110462612
N-[2-(1H-benzimidazol-2-yl)ethyl]-2,3-dimethylquinoxaline-6-carboxamide
CID 21008897
4-[2-(1H-benzimidazol-2-ylmethylamino)ethyl]-N-benzylbenzamide
CID 129067460
N-[2-(1H-benzimidazol-2-yl)ethyl]-4-[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]benzamide
CID 18277864
N-[2-(1H-benzimidazol-2-yl)ethyl]-4-butoxybenzamide
CID 4917285
N-[2-(1H-benzimidazol-2-yl)ethyl]-4-(dimethylsulfamoyl)benzamide
CID 4825744
N-[3-(1H-benzimidazol-2-yl)propyl]-4-methylbenzamide
CID 134032779
3-acetamido-N-[2-(1H-benzimidazol-2-yl)ethyl]propanamide
CID 43229201
N-[4-[2-(1H-benzimidazol-2-yl)ethylamino]-4-oxobutyl]benzamide
CID 32757779
N-[2-(1H-benzimidazol-2-yl)ethyl]-4-(difluoromethoxy)benzamide
CID 27161540
N-[2-(1H-benzimidazol-2-yl)ethyl]-4-(diethylsulfamoyl)benzamide
CID 21008890
N-[2-(1H-benzimidazol-2-yl)ethyl]-4-(2,5-dioxopyrrolidin-1-yl)benzamide
CID 30209277

Frequently Asked Questions

What is the IUPAC name of 4-(acetamidomethyl)-N-[2-(1H-benzimidazol-2-yl)ethyl]benzamide?
The IUPAC name of 4-(acetamidomethyl)-N-[2-(1H-benzimidazol-2-yl)ethyl]benzamide (CID 17394585) is 4-(acetamidomethyl)-N-[2-(1H-benzimidazol-2-yl)ethyl]benzamide.
What is the SMILES notation for 4-(acetamidomethyl)-N-[2-(1H-benzimidazol-2-yl)ethyl]benzamide?
The canonical SMILES for 4-(acetamidomethyl)-N-[2-(1H-benzimidazol-2-yl)ethyl]benzamide is CC(=O)NCc1ccc(C(=O)NCCc2nc3ccccc3[nH]2)cc1.
What is the InChIKey of 4-(acetamidomethyl)-N-[2-(1H-benzimidazol-2-yl)ethyl]benzamide?
The InChIKey is DPQBQMSFFARTSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O2/c1-13(24)21-12-14-6-8-15(9-7-14)19(25)20-11-10-18-22-16-4-2-3-5-17(16)23-18/h2-9H,10-12H2,1H3,(H,20,25)(H,21,24)(H,22,23).
What are the key properties of 4-(acetamidomethyl)-N-[2-(1H-benzimidazol-2-yl)ethyl]benzamide?
4-(acetamidomethyl)-N-[2-(1H-benzimidazol-2-yl)ethyl]benzamide has a molecular weight of 336.40 g/mol, XLogP of 2.17, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(acetamidomethyl)-N-[2-(1H-benzimidazol-2-yl)ethyl]benzamide is sourced from PubChem (CID 17394585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).