5-(aminomethyl)-N-benzylpyridine-2-carboxamide

C14H15N3O — CID 55230776

IUPAC5-(aminomethyl)-N-benzylpyridine-2-carboxamide
SMILESNCc1ccc(C(=O)NCc2ccccc2)nc1
InChIInChI=1S/C14H15N3O/c15-8-12-6-7-13(16-10-12)14(18)17-9-11-4-2-1-3-5-11/h1-7,10H,8-9,15H2,(H,17,18)
InChIKeyFRTMDZGQAKSMTB-UHFFFAOYSA-N
MW241.29 g/mol
LogP1.47
Rot. Bonds4

About 5-(aminomethyl)-N-benzylpyridine-2-carboxamide

5-(aminomethyl)-N-benzylpyridine-2-carboxamide (PubChem CID 55230776) has the molecular formula C14H15N3O and a molecular weight of 241.29 g/mol. Its IUPAC name is 5-(aminomethyl)-N-benzylpyridine-2-carboxamide.

Molecular Properties

Compound Name5-(aminomethyl)-N-benzylpyridine-2-carboxamide
PubChem CID55230776
Molecular FormulaC14H15N3O
Molecular Weight241.29 g/mol
Exact Mass241.12
IUPAC Name5-(aminomethyl)-N-benzylpyridine-2-carboxamide
SMILESNCc1ccc(C(=O)NCc2ccccc2)nc1
InChIInChI=1S/C14H15N3O/c15-8-12-6-7-13(16-10-12)14(18)17-9-11-4-2-1-3-5-11/h1-7,10H,8-9,15H2,(H,17,18)
InChIKeyFRTMDZGQAKSMTB-UHFFFAOYSA-N
XLogP1.47
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 5-(aminomethyl)-N-benzylpyridine-2-carboxamide 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

5-(aminomethyl)-N-(1H-pyrazol-4-ylmethyl)pyridine-2-carboxamide
CID 63722358
5-anilino-N-benzylpyridine-2-carboxamide
CID 109187879
5-(aminomethyl)-N-[(3-methoxyphenyl)methyl]pyridine-2-carboxamide
CID 63724046
5-(aminomethyl)-N-(thiophen-2-ylmethyl)pyridine-2-carboxamide
CID 115116726
5-(aminomethyl)-N-(2,2-dimethylpropyl)pyridine-2-carboxamide
CID 63724390
N-benzyl-5-(pyridin-2-ylmethylamino)pyridine-2-carboxamide
CID 109187835
5-(aminomethyl)-N-[(5-bromothiophen-2-yl)methyl]pyridine-2-carboxamide
CID 115116731
5-(aminomethyl)-N-[(1R)-1-phenylethyl]pyridine-2-carboxamide
CID 107863938
5-(aminomethyl)-N-[2-(2-bromophenyl)ethyl]pyridine-2-carboxamide
CID 115116754
N-benzyl-5-(3-hydroxyprop-1-ynyl)pyridine-2-carboxamide
CID 62958951
N-benzyl-5-(benzylamino)pyrazine-2-carboxamide
CID 109279637
5-phenyl-N-(pyridin-4-ylmethyl)pyridine-2-carboxamide
CID 110683582

Frequently Asked Questions

What is the IUPAC name of 5-(aminomethyl)-N-benzylpyridine-2-carboxamide?
The IUPAC name of 5-(aminomethyl)-N-benzylpyridine-2-carboxamide (CID 55230776) is 5-(aminomethyl)-N-benzylpyridine-2-carboxamide.
What is the SMILES notation for 5-(aminomethyl)-N-benzylpyridine-2-carboxamide?
The canonical SMILES for 5-(aminomethyl)-N-benzylpyridine-2-carboxamide is NCc1ccc(C(=O)NCc2ccccc2)nc1.
What is the InChIKey of 5-(aminomethyl)-N-benzylpyridine-2-carboxamide?
The InChIKey is FRTMDZGQAKSMTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O/c15-8-12-6-7-13(16-10-12)14(18)17-9-11-4-2-1-3-5-11/h1-7,10H,8-9,15H2,(H,17,18).
What are the key properties of 5-(aminomethyl)-N-benzylpyridine-2-carboxamide?
5-(aminomethyl)-N-benzylpyridine-2-carboxamide has a molecular weight of 241.29 g/mol, XLogP of 1.47, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(aminomethyl)-N-benzylpyridine-2-carboxamide is sourced from PubChem (CID 55230776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).