3-chloro-6-(methylamino)-N-(5-methyl-3-pyridinyl)pyridine-2-carboxamide

C13H13ClN4O — CID 107586618

IUPAC3-chloro-6-(methylamino)-N-(5-methyl-3-pyridinyl)pyridine-2-carboxamide
SMILESCNc1ccc(Cl)c(C(=O)Nc2cncc(C)c2)n1
InChIInChI=1S/C13H13ClN4O/c1-8-5-9(7-16-6-8)17-13(19)12-10(14)3-4-11(15-2)18-12/h3-7H,1-2H3,(H,15,18)(H,17,19)
InChIKeyJWLNWGDEUZCOBP-UHFFFAOYSA-N
MW276.73 g/mol
LogP2.73
Rot. Bonds3

About 3-chloro-6-(methylamino)-N-(5-methyl-3-pyridinyl)pyridine-2-carboxamide

3-chloro-6-(methylamino)-N-(5-methyl-3-pyridinyl)pyridine-2-carboxamide (PubChem CID 107586618) has the molecular formula C13H13ClN4O and a molecular weight of 276.73 g/mol. Its IUPAC name is 3-chloro-6-(methylamino)-N-(5-methyl-3-pyridinyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name3-chloro-6-(methylamino)-N-(5-methyl-3-pyridinyl)pyridine-2-carboxamide
PubChem CID107586618
Molecular FormulaC13H13ClN4O
Molecular Weight276.73 g/mol
Exact Mass276.08
IUPAC Name3-chloro-6-(methylamino)-N-(5-methyl-3-pyridinyl)pyridine-2-carboxamide
SMILESCNc1ccc(Cl)c(C(=O)Nc2cncc(C)c2)n1
InChIInChI=1S/C13H13ClN4O/c1-8-5-9(7-16-6-8)17-13(19)12-10(14)3-4-11(15-2)18-12/h3-7H,1-2H3,(H,15,18)(H,17,19)
InChIKeyJWLNWGDEUZCOBP-UHFFFAOYSA-N
XLogP2.73
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.73
LogP ≤ 52.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 3-chloro-6-(methylamino)-N-(5-methyl-3-pyridinyl)pyridine-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

Frequently Asked Questions

What is the IUPAC name of 3-chloro-6-(methylamino)-N-(5-methyl-3-pyridinyl)pyridine-2-carboxamide?
The IUPAC name of 3-chloro-6-(methylamino)-N-(5-methyl-3-pyridinyl)pyridine-2-carboxamide (CID 107586618) is 3-chloro-6-(methylamino)-N-(5-methyl-3-pyridinyl)pyridine-2-carboxamide.
What is the SMILES notation for 3-chloro-6-(methylamino)-N-(5-methyl-3-pyridinyl)pyridine-2-carboxamide?
The canonical SMILES for 3-chloro-6-(methylamino)-N-(5-methyl-3-pyridinyl)pyridine-2-carboxamide is CNc1ccc(Cl)c(C(=O)Nc2cncc(C)c2)n1.
What is the InChIKey of 3-chloro-6-(methylamino)-N-(5-methyl-3-pyridinyl)pyridine-2-carboxamide?
The InChIKey is JWLNWGDEUZCOBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13ClN4O/c1-8-5-9(7-16-6-8)17-13(19)12-10(14)3-4-11(15-2)18-12/h3-7H,1-2H3,(H,15,18)(H,17,19).
What are the key properties of 3-chloro-6-(methylamino)-N-(5-methyl-3-pyridinyl)pyridine-2-carboxamide?
3-chloro-6-(methylamino)-N-(5-methyl-3-pyridinyl)pyridine-2-carboxamide has a molecular weight of 276.73 g/mol, XLogP of 2.73, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-6-(methylamino)-N-(5-methyl-3-pyridinyl)pyridine-2-carboxamide is sourced from PubChem (CID 107586618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).