6-chloro-N-(2-chloro-5-methylphenyl)pyridine-3-carboxamide

C13H10Cl2N2O — CID 103769566

IUPAC6-chloro-N-(2-chloro-5-methylphenyl)pyridine-3-carboxamide
SMILESCc1ccc(Cl)c(NC(=O)c2ccc(Cl)nc2)c1
InChIInChI=1S/C13H10Cl2N2O/c1-8-2-4-10(14)11(6-8)17-13(18)9-3-5-12(15)16-7-9/h2-7H,1H3,(H,17,18)
InChIKeyNBYQDGHOQOJNEE-UHFFFAOYSA-N
MW281.14 g/mol
LogP3.95
Rot. Bonds2

About 6-chloro-N-(2-chloro-5-methylphenyl)pyridine-3-carboxamide

6-chloro-N-(2-chloro-5-methylphenyl)pyridine-3-carboxamide (PubChem CID 103769566) has the molecular formula C13H10Cl2N2O and a molecular weight of 281.14 g/mol. Its IUPAC name is 6-chloro-N-(2-chloro-5-methylphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-chloro-N-(2-chloro-5-methylphenyl)pyridine-3-carboxamide
PubChem CID103769566
Molecular FormulaC13H10Cl2N2O
Molecular Weight281.14 g/mol
Exact Mass280.02
IUPAC Name6-chloro-N-(2-chloro-5-methylphenyl)pyridine-3-carboxamide
SMILESCc1ccc(Cl)c(NC(=O)c2ccc(Cl)nc2)c1
InChIInChI=1S/C13H10Cl2N2O/c1-8-2-4-10(14)11(6-8)17-13(18)9-3-5-12(15)16-7-9/h2-7H,1H3,(H,17,18)
InChIKeyNBYQDGHOQOJNEE-UHFFFAOYSA-N
XLogP3.95
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.14
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

6-chloro-N-[2-chloro-5-(methylcarbamoyl)phenyl]pyridine-3-carboxamide
CID 60795097
6-chloro-N-(5-methyl-2-nitrophenyl)pyridine-3-carboxamide
CID 115912537
1-N,3-N-bis(2-chloro-5-methylphenyl)benzene-1,3-dicarboxamide
CID 4179240
6-chloro-N-(4-chloro-3-methylphenyl)pyridine-3-carboxamide
CID 91312921
6-chloro-N-(2-methylphenyl)pyridine-3-carboxamide
CID 2599141
N-(2-chloro-5-methylphenyl)-3,4-dihydroxybenzamide
CID 103957548
6-chloro-N-(5-chloro-2-fluorophenyl)pyridine-3-carboxamide
CID 43384926
4-amino-N-(2-chloro-5-methylphenyl)-3-hydroxybenzamide
CID 107624052
6-chloro-N-(2-chloropyrimidin-5-yl)pyridine-3-carboxamide
CID 10125350
4-chloro-N-(2-chloro-5-methylphenyl)-3-nitrobenzamide
CID 102504215
6-chloro-N-(5-cyano-2-methylphenyl)pyridine-3-carboxamide
CID 47475855
6-amino-N-(2,5-dimethylphenyl)pyridine-3-carboxamide
CID 62155556

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(2-chloro-5-methylphenyl)pyridine-3-carboxamide?
The IUPAC name of 6-chloro-N-(2-chloro-5-methylphenyl)pyridine-3-carboxamide (CID 103769566) is 6-chloro-N-(2-chloro-5-methylphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 6-chloro-N-(2-chloro-5-methylphenyl)pyridine-3-carboxamide?
The canonical SMILES for 6-chloro-N-(2-chloro-5-methylphenyl)pyridine-3-carboxamide is Cc1ccc(Cl)c(NC(=O)c2ccc(Cl)nc2)c1.
What is the InChIKey of 6-chloro-N-(2-chloro-5-methylphenyl)pyridine-3-carboxamide?
The InChIKey is NBYQDGHOQOJNEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10Cl2N2O/c1-8-2-4-10(14)11(6-8)17-13(18)9-3-5-12(15)16-7-9/h2-7H,1H3,(H,17,18).
What are the key properties of 6-chloro-N-(2-chloro-5-methylphenyl)pyridine-3-carboxamide?
6-chloro-N-(2-chloro-5-methylphenyl)pyridine-3-carboxamide has a molecular weight of 281.14 g/mol, XLogP of 3.95, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(2-chloro-5-methylphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 103769566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).