2-[(2-phenylacetyl)amino]-N-(pyridin-3-ylmethyl)benzamide

C21H19N3O2 — CID 2986089

IUPAC2-[(2-phenylacetyl)amino]-N-(pyridin-3-ylmethyl)benzamide
SMILESO=C(Cc1ccccc1)Nc1ccccc1C(=O)NCc1cccnc1
InChIInChI=1S/C21H19N3O2/c25-20(13-16-7-2-1-3-8-16)24-19-11-5-4-10-18(19)21(26)23-15-17-9-6-12-22-14-17/h1-12,14H,13,15H2,(H,23,26)(H,24,25)
InChIKeyLRKHGVPUAHKZMV-UHFFFAOYSA-N
MW345.40 g/mol
LogP3.19
Rot. Bonds6

About 2-[(2-phenylacetyl)amino]-N-(pyridin-3-ylmethyl)benzamide

2-[(2-phenylacetyl)amino]-N-(pyridin-3-ylmethyl)benzamide (PubChem CID 2986089) has the molecular formula C21H19N3O2 and a molecular weight of 345.40 g/mol. Its IUPAC name is 2-[(2-phenylacetyl)amino]-N-(pyridin-3-ylmethyl)benzamide.

Molecular Properties

Compound Name2-[(2-phenylacetyl)amino]-N-(pyridin-3-ylmethyl)benzamide
PubChem CID2986089
Molecular FormulaC21H19N3O2
Molecular Weight345.40 g/mol
Exact Mass345.15
IUPAC Name2-[(2-phenylacetyl)amino]-N-(pyridin-3-ylmethyl)benzamide
SMILESO=C(Cc1ccccc1)Nc1ccccc1C(=O)NCc1cccnc1
InChIInChI=1S/C21H19N3O2/c25-20(13-16-7-2-1-3-8-16)24-19-11-5-4-10-18(19)21(26)23-15-17-9-6-12-22-14-17/h1-12,14H,13,15H2,(H,23,26)(H,24,25)
InChIKeyLRKHGVPUAHKZMV-UHFFFAOYSA-N
XLogP3.19
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.40
LogP ≤ 53.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-[(2-phenylacetyl)amino]-N-(pyridin-3-ylmethyl)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-(4-aminopentanoylamino)-N-(pyridin-3-ylmethyl)benzamide
CID 120565146
N-(pyridin-3-ylmethyl)-2-[2-(pyridin-3-ylmethylcarbamoyl)phenyl]benzamide
CID 1279662
N-[(2S)-2-hydroxypropyl]-N'-[2-(pyridin-3-ylmethylcarbamoyl)phenyl]oxamide
CID 51815485
2-[[2-(2-methoxyphenoxy)acetyl]amino]-N-(pyridin-3-ylmethyl)benzamide
CID 6459085
2-[[2-(3,5-dimethylphenoxy)acetyl]amino]-N-(pyridin-3-ylmethyl)benzamide
CID 21173810
2-[[(Z)-2,3-diphenylprop-2-enoyl]amino]-N-(pyridin-3-ylmethyl)benzamide
CID 17200377
2-[[2-(1-methoxycyclobutyl)acetyl]amino]-N-(pyridin-3-ylmethyl)benzamide
CID 119047422
2-chloro-N-(pyridin-3-ylmethyl)benzamide
CID 669068
2-[(4-methoxybenzoyl)amino]-N-(pyridin-3-ylmethyl)benzamide
CID 991450
2-[(4-fluorophenyl)carbamothioylamino]-N-(pyridin-3-ylmethyl)benzamide
CID 100641344
2-[(3-chlorobenzoyl)amino]-N-(pyridin-3-ylmethyl)benzamide
CID 6457396
2-[(4-methylphenyl)carbamothioylamino]-N-(pyridin-3-ylmethyl)benzamide
CID 100639374

Frequently Asked Questions

What is the IUPAC name of 2-[(2-phenylacetyl)amino]-N-(pyridin-3-ylmethyl)benzamide?
The IUPAC name of 2-[(2-phenylacetyl)amino]-N-(pyridin-3-ylmethyl)benzamide (CID 2986089) is 2-[(2-phenylacetyl)amino]-N-(pyridin-3-ylmethyl)benzamide.
What is the SMILES notation for 2-[(2-phenylacetyl)amino]-N-(pyridin-3-ylmethyl)benzamide?
The canonical SMILES for 2-[(2-phenylacetyl)amino]-N-(pyridin-3-ylmethyl)benzamide is O=C(Cc1ccccc1)Nc1ccccc1C(=O)NCc1cccnc1.
What is the InChIKey of 2-[(2-phenylacetyl)amino]-N-(pyridin-3-ylmethyl)benzamide?
The InChIKey is LRKHGVPUAHKZMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N3O2/c25-20(13-16-7-2-1-3-8-16)24-19-11-5-4-10-18(19)21(26)23-15-17-9-6-12-22-14-17/h1-12,14H,13,15H2,(H,23,26)(H,24,25).
What are the key properties of 2-[(2-phenylacetyl)amino]-N-(pyridin-3-ylmethyl)benzamide?
2-[(2-phenylacetyl)amino]-N-(pyridin-3-ylmethyl)benzamide has a molecular weight of 345.40 g/mol, XLogP of 3.19, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-phenylacetyl)amino]-N-(pyridin-3-ylmethyl)benzamide is sourced from PubChem (CID 2986089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).