N-[2-(aminomethyl)phenyl]pyridine-2-carboxamide

C13H13N3O — CID 16773462

IUPACN-[2-(aminomethyl)phenyl]pyridine-2-carboxamide
SMILESNCc1ccccc1NC(=O)c1ccccn1
InChIInChI=1S/C13H13N3O/c14-9-10-5-1-2-6-11(10)16-13(17)12-7-3-4-8-15-12/h1-8H,9,14H2,(H,16,17)
InChIKeyJWMKNYFQUNJYNC-UHFFFAOYSA-N
MW227.27 g/mol
LogP1.79
Rot. Bonds3

About N-[2-(aminomethyl)phenyl]pyridine-2-carboxamide

N-[2-(aminomethyl)phenyl]pyridine-2-carboxamide (PubChem CID 16773462) has the molecular formula C13H13N3O and a molecular weight of 227.27 g/mol. Its IUPAC name is N-[2-(aminomethyl)phenyl]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[2-(aminomethyl)phenyl]pyridine-2-carboxamide
PubChem CID16773462
Molecular FormulaC13H13N3O
Molecular Weight227.27 g/mol
Exact Mass227.11
IUPAC NameN-[2-(aminomethyl)phenyl]pyridine-2-carboxamide
SMILESNCc1ccccc1NC(=O)c1ccccn1
InChIInChI=1S/C13H13N3O/c14-9-10-5-1-2-6-11(10)16-13(17)12-7-3-4-8-15-12/h1-8H,9,14H2,(H,16,17)
InChIKeyJWMKNYFQUNJYNC-UHFFFAOYSA-N
XLogP1.79
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.27
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(pyridine-2-carbonylamino)phenyl]pyridine-2-carboxamide;ruthenium(2+);dichloride
CID 46845295
N-[2-(aminomethyl)phenyl]thiadiazole-4-carboxamide
CID 65216285
N-[2-(aminomethyl)phenyl]carbamoyl chloride
CID 142823786
N-[2-(aminomethyl)phenyl]quinoxaline-6-carboxamide
CID 63754296
N-[3-(aminomethyl)-4-fluorophenyl]pyridine-2-carboxamide
CID 62317302
N-(2-carbamothioylphenyl)pyridine-2-carboxamide
CID 24701542
2-[2-[(4-chloropyridine-2-carbonyl)amino]phenyl]acetic acid
CID 62535920
N-(2,6-diethylphenyl)pyridine-2-carboxamide
CID 19224278
N-[2-(aminomethyl)phenyl]-2-iodobenzamide
CID 64882136
N-[[2-[(2,2,2-trifluoroacetyl)amino]phenyl]methyl]pyridine-2-carboxamide
CID 108934218
N-[2-(aminomethyl)phenyl]-3,5-dihydroxybenzamide
CID 107705031
N-[2-(aminomethyl)phenyl]-2,3-dichlorobenzamide
CID 64882330

Frequently Asked Questions

What is the IUPAC name of N-[2-(aminomethyl)phenyl]pyridine-2-carboxamide?
The IUPAC name of N-[2-(aminomethyl)phenyl]pyridine-2-carboxamide (CID 16773462) is N-[2-(aminomethyl)phenyl]pyridine-2-carboxamide.
What is the SMILES notation for N-[2-(aminomethyl)phenyl]pyridine-2-carboxamide?
The canonical SMILES for N-[2-(aminomethyl)phenyl]pyridine-2-carboxamide is NCc1ccccc1NC(=O)c1ccccn1.
What is the InChIKey of N-[2-(aminomethyl)phenyl]pyridine-2-carboxamide?
The InChIKey is JWMKNYFQUNJYNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N3O/c14-9-10-5-1-2-6-11(10)16-13(17)12-7-3-4-8-15-12/h1-8H,9,14H2,(H,16,17).
What are the key properties of N-[2-(aminomethyl)phenyl]pyridine-2-carboxamide?
N-[2-(aminomethyl)phenyl]pyridine-2-carboxamide has a molecular weight of 227.27 g/mol, XLogP of 1.79, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(aminomethyl)phenyl]pyridine-2-carboxamide is sourced from PubChem (CID 16773462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).