N-(3-methylphenyl)pyridine-3-carboxamide

C13H12N2O — CID 532819

IUPACN-(3-methylphenyl)pyridine-3-carboxamide
SMILESCc1cccc(NC(=O)c2cccnc2)c1
InChIInChI=1S/C13H12N2O/c1-10-4-2-6-12(8-10)15-13(16)11-5-3-7-14-9-11/h2-9H,1H3,(H,15,16)
InChIKeyXZDOYZLZHKFSOX-UHFFFAOYSA-N
MW212.25 g/mol
LogP2.64
Rot. Bonds2

About N-(3-methylphenyl)pyridine-3-carboxamide

N-(3-methylphenyl)pyridine-3-carboxamide (PubChem CID 532819) has the molecular formula C13H12N2O and a molecular weight of 212.25 g/mol. Its IUPAC name is N-(3-methylphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3-methylphenyl)pyridine-3-carboxamide
PubChem CID532819
Molecular FormulaC13H12N2O
Molecular Weight212.25 g/mol
Exact Mass212.09
IUPAC NameN-(3-methylphenyl)pyridine-3-carboxamide
SMILESCc1cccc(NC(=O)c2cccnc2)c1
InChIInChI=1S/C13H12N2O/c1-10-4-2-6-12(8-10)15-13(16)11-5-3-7-14-9-11/h2-9H,1H3,(H,15,16)
InChIKeyXZDOYZLZHKFSOX-UHFFFAOYSA-N
XLogP2.64
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.25
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(3-methylphenyl)pyridine-3-carboxamide?
The IUPAC name of N-(3-methylphenyl)pyridine-3-carboxamide (CID 532819) is N-(3-methylphenyl)pyridine-3-carboxamide.
What is the SMILES notation for N-(3-methylphenyl)pyridine-3-carboxamide?
The canonical SMILES for N-(3-methylphenyl)pyridine-3-carboxamide is Cc1cccc(NC(=O)c2cccnc2)c1.
What is the InChIKey of N-(3-methylphenyl)pyridine-3-carboxamide?
The InChIKey is XZDOYZLZHKFSOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N2O/c1-10-4-2-6-12(8-10)15-13(16)11-5-3-7-14-9-11/h2-9H,1H3,(H,15,16).
What are the key properties of N-(3-methylphenyl)pyridine-3-carboxamide?
N-(3-methylphenyl)pyridine-3-carboxamide has a molecular weight of 212.25 g/mol, XLogP of 2.64, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 532819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).