N-[2-(benzamidomethyl)phenyl]pyridine-3-carboxamide

C20H17N3O2 — CID 108926022

IUPACN-[2-(benzamidomethyl)phenyl]pyridine-3-carboxamide
SMILESO=C(NCc1ccccc1NC(=O)c1cccnc1)c1ccccc1
InChIInChI=1S/C20H17N3O2/c24-19(15-7-2-1-3-8-15)22-14-16-9-4-5-11-18(16)23-20(25)17-10-6-12-21-13-17/h1-13H,14H2,(H,22,24)(H,23,25)
InChIKeyDBPWATGWNZQNSW-UHFFFAOYSA-N
MW331.38 g/mol
LogP3.26
Rot. Bonds5

About N-[2-(benzamidomethyl)phenyl]pyridine-3-carboxamide

N-[2-(benzamidomethyl)phenyl]pyridine-3-carboxamide (PubChem CID 108926022) has the molecular formula C20H17N3O2 and a molecular weight of 331.38 g/mol. Its IUPAC name is N-[2-(benzamidomethyl)phenyl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[2-(benzamidomethyl)phenyl]pyridine-3-carboxamide
PubChem CID108926022
Molecular FormulaC20H17N3O2
Molecular Weight331.38 g/mol
Exact Mass331.13
IUPAC NameN-[2-(benzamidomethyl)phenyl]pyridine-3-carboxamide
SMILESO=C(NCc1ccccc1NC(=O)c1cccnc1)c1ccccc1
InChIInChI=1S/C20H17N3O2/c24-19(15-7-2-1-3-8-15)22-14-16-9-4-5-11-18(16)23-20(25)17-10-6-12-21-13-17/h1-13H,14H2,(H,22,24)(H,23,25)
InChIKeyDBPWATGWNZQNSW-UHFFFAOYSA-N
XLogP3.26
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.38
LogP ≤ 53.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-[(pyridine-4-carbonylamino)methyl]phenyl]pyridine-3-carboxamide
CID 108926052
N-[[2-(pyridine-4-carbonylamino)phenyl]methyl]pyridine-3-carboxamide
CID 108926051
N-[[2-[(3,4,5-trihydroxybenzoyl)amino]phenyl]methyl]pyridine-3-carboxamide
CID 108925899
N-[[2-[(2,2-diphenylacetyl)amino]phenyl]methyl]pyridine-3-carboxamide
CID 108925855
N-[2-[[(2-iodobenzoyl)amino]methyl]phenyl]pyridine-3-carboxamide
CID 108925872
N-[[2-[(3,4-dimethylbenzoyl)amino]phenyl]methyl]pyridine-3-carboxamide
CID 108926065
N-[[2-[(2-phenoxyacetyl)amino]phenyl]methyl]pyridine-3-carboxamide
CID 108926017
N-[[2-[[2-(2-fluorophenyl)acetyl]amino]phenyl]methyl]pyridine-3-carboxamide
CID 108926099
N-[[2-[(3,4-dimethoxybenzoyl)amino]phenyl]methyl]pyridine-3-carboxamide
CID 108925835
N-[2-[(3-methoxypropanoylamino)methyl]phenyl]pyridine-3-carboxamide
CID 108926036
3-[2-(pyridine-3-carbonylamino)phenyl]propanoic acid
CID 107272327
N-[2-[(2-benzamidoacetyl)amino]phenyl]pyridine-3-carboxamide
CID 108925269

Frequently Asked Questions

What is the IUPAC name of N-[2-(benzamidomethyl)phenyl]pyridine-3-carboxamide?
The IUPAC name of N-[2-(benzamidomethyl)phenyl]pyridine-3-carboxamide (CID 108926022) is N-[2-(benzamidomethyl)phenyl]pyridine-3-carboxamide.
What is the SMILES notation for N-[2-(benzamidomethyl)phenyl]pyridine-3-carboxamide?
The canonical SMILES for N-[2-(benzamidomethyl)phenyl]pyridine-3-carboxamide is O=C(NCc1ccccc1NC(=O)c1cccnc1)c1ccccc1.
What is the InChIKey of N-[2-(benzamidomethyl)phenyl]pyridine-3-carboxamide?
The InChIKey is DBPWATGWNZQNSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N3O2/c24-19(15-7-2-1-3-8-15)22-14-16-9-4-5-11-18(16)23-20(25)17-10-6-12-21-13-17/h1-13H,14H2,(H,22,24)(H,23,25).
What are the key properties of N-[2-(benzamidomethyl)phenyl]pyridine-3-carboxamide?
N-[2-(benzamidomethyl)phenyl]pyridine-3-carboxamide has a molecular weight of 331.38 g/mol, XLogP of 3.26, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(benzamidomethyl)phenyl]pyridine-3-carboxamide is sourced from PubChem (CID 108926022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).