N-[[2-(aminomethyl)phenyl]methyl]-N-methylpyridine-2-carboxamide

C15H17N3O — CID 54939155

IUPACN-[[2-(aminomethyl)phenyl]methyl]-N-methylpyridine-2-carboxamide
SMILESCN(Cc1ccccc1CN)C(=O)c1ccccn1
InChIInChI=1S/C15H17N3O/c1-18(15(19)14-8-4-5-9-17-14)11-13-7-3-2-6-12(13)10-16/h2-9H,10-11,16H2,1H3
InChIKeyVLDJPLJDOFAJKX-UHFFFAOYSA-N
MW255.32 g/mol
LogP1.81
Rot. Bonds4

About N-[[2-(aminomethyl)phenyl]methyl]-N-methylpyridine-2-carboxamide

N-[[2-(aminomethyl)phenyl]methyl]-N-methylpyridine-2-carboxamide (PubChem CID 54939155) has the molecular formula C15H17N3O and a molecular weight of 255.32 g/mol. Its IUPAC name is N-[[2-(aminomethyl)phenyl]methyl]-N-methylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-[[2-(aminomethyl)phenyl]methyl]-N-methylpyridine-2-carboxamide
PubChem CID54939155
Molecular FormulaC15H17N3O
Molecular Weight255.32 g/mol
Exact Mass255.14
IUPAC NameN-[[2-(aminomethyl)phenyl]methyl]-N-methylpyridine-2-carboxamide
SMILESCN(Cc1ccccc1CN)C(=O)c1ccccn1
InChIInChI=1S/C15H17N3O/c1-18(15(19)14-8-4-5-9-17-14)11-13-7-3-2-6-12(13)10-16/h2-9H,10-11,16H2,1H3
InChIKeyVLDJPLJDOFAJKX-UHFFFAOYSA-N
XLogP1.81
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[[2-(aminomethyl)phenyl]methyl]-N-methylpyridine-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

N-methyl-N-[2-[methyl(pyridine-2-carbonyl)amino]ethyl]pyridine-2-carboxamide
CID 86031517
N-[(2,4-difluorophenyl)methyl]-N-methylpyridine-2-carboxamide
CID 134046590
N-[[2-(aminomethyl)phenyl]methyl]-N-methylpyridine-3-carboxamide
CID 54939157
N-methylpyridine-2-carbohydrazide
CID 45084309
N-(2-chloropropyl)-N-methylpyridine-2-carboxamide
CID 63393519
N-[[2-(aminomethyl)phenyl]methyl]-3,5-difluoro-N-methylbenzamide
CID 60922714
N-[(5-bromothiophen-2-yl)methyl]-N-methylpyridine-2-carboxamide
CID 78792331
N-[[2-(aminomethyl)phenyl]methyl]-N-methylpyridin-2-amine
CID 60921940
methyl 2-[methyl(pyridine-2-carbonyl)amino]acetate
CID 43407333
N-[[2-(aminomethyl)phenyl]methyl]-N-methylfuran-3-carboxamide
CID 54939111
N-[[2-(aminomethyl)phenyl]methyl]-N,3-dimethylbenzamide
CID 60923258
N-[[2-(aminomethyl)phenyl]methyl]-3,4-difluoro-N-methylbenzamide
CID 60922987

Frequently Asked Questions

What is the IUPAC name of N-[[2-(aminomethyl)phenyl]methyl]-N-methylpyridine-2-carboxamide?
The IUPAC name of N-[[2-(aminomethyl)phenyl]methyl]-N-methylpyridine-2-carboxamide (CID 54939155) is N-[[2-(aminomethyl)phenyl]methyl]-N-methylpyridine-2-carboxamide.
What is the SMILES notation for N-[[2-(aminomethyl)phenyl]methyl]-N-methylpyridine-2-carboxamide?
The canonical SMILES for N-[[2-(aminomethyl)phenyl]methyl]-N-methylpyridine-2-carboxamide is CN(Cc1ccccc1CN)C(=O)c1ccccn1.
What is the InChIKey of N-[[2-(aminomethyl)phenyl]methyl]-N-methylpyridine-2-carboxamide?
The InChIKey is VLDJPLJDOFAJKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O/c1-18(15(19)14-8-4-5-9-17-14)11-13-7-3-2-6-12(13)10-16/h2-9H,10-11,16H2,1H3.
What are the key properties of N-[[2-(aminomethyl)phenyl]methyl]-N-methylpyridine-2-carboxamide?
N-[[2-(aminomethyl)phenyl]methyl]-N-methylpyridine-2-carboxamide has a molecular weight of 255.32 g/mol, XLogP of 1.81, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(aminomethyl)phenyl]methyl]-N-methylpyridine-2-carboxamide is sourced from PubChem (CID 54939155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).