2,4-dichloro-6-methylpyridine-3-carboxamide

C7H6Cl2N2O — CID 778197

IUPAC2,4-dichloro-6-methylpyridine-3-carboxamide
SMILESCc1cc(Cl)c(C(N)=O)c(Cl)n1
InChIInChI=1S/C7H6Cl2N2O/c1-3-2-4(8)5(7(10)12)6(9)11-3/h2H,1H3,(H2,10,12)
InChIKeyFTFWEWFQKLHODH-UHFFFAOYSA-N
MW205.04 g/mol
LogP1.80
Rot. Bonds1

About 2,4-dichloro-6-methylpyridine-3-carboxamide

2,4-dichloro-6-methylpyridine-3-carboxamide (PubChem CID 778197) has the molecular formula C7H6Cl2N2O and a molecular weight of 205.04 g/mol. Its IUPAC name is 2,4-dichloro-6-methylpyridine-3-carboxamide.

Molecular Properties

Compound Name2,4-dichloro-6-methylpyridine-3-carboxamide
PubChem CID778197
Molecular FormulaC7H6Cl2N2O
Molecular Weight205.04 g/mol
Exact Mass203.99
IUPAC Name2,4-dichloro-6-methylpyridine-3-carboxamide
SMILESCc1cc(Cl)c(C(N)=O)c(Cl)n1
InChIInChI=1S/C7H6Cl2N2O/c1-3-2-4(8)5(7(10)12)6(9)11-3/h2H,1H3,(H2,10,12)
InChIKeyFTFWEWFQKLHODH-UHFFFAOYSA-N
XLogP1.80
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.04
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 2,4-dichloro-6-methylpyridine-3-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 2,4-dichloro-6-methylpyridine-3-carboxamide?
The IUPAC name of 2,4-dichloro-6-methylpyridine-3-carboxamide (CID 778197) is 2,4-dichloro-6-methylpyridine-3-carboxamide.
What is the SMILES notation for 2,4-dichloro-6-methylpyridine-3-carboxamide?
The canonical SMILES for 2,4-dichloro-6-methylpyridine-3-carboxamide is Cc1cc(Cl)c(C(N)=O)c(Cl)n1.
What is the InChIKey of 2,4-dichloro-6-methylpyridine-3-carboxamide?
The InChIKey is FTFWEWFQKLHODH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6Cl2N2O/c1-3-2-4(8)5(7(10)12)6(9)11-3/h2H,1H3,(H2,10,12).
What are the key properties of 2,4-dichloro-6-methylpyridine-3-carboxamide?
2,4-dichloro-6-methylpyridine-3-carboxamide has a molecular weight of 205.04 g/mol, XLogP of 1.80, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-6-methylpyridine-3-carboxamide is sourced from PubChem (CID 778197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).