5,6-dichloro-N-(5-chloro-2-methoxyphenyl)pyridine-3-carboxamide

C13H9Cl3N2O2 — CID 4856255

IUPAC5,6-dichloro-N-(5-chloro-2-methoxyphenyl)pyridine-3-carboxamide
SMILESCOc1ccc(Cl)cc1NC(=O)c1cnc(Cl)c(Cl)c1
InChIInChI=1S/C13H9Cl3N2O2/c1-20-11-3-2-8(14)5-10(11)18-13(19)7-4-9(15)12(16)17-6-7/h2-6H,1H3,(H,18,19)
InChIKeyUCORRPCIYCBALM-UHFFFAOYSA-N
MW331.59 g/mol
LogP4.30
Rot. Bonds3

About 5,6-dichloro-N-(5-chloro-2-methoxyphenyl)pyridine-3-carboxamide

5,6-dichloro-N-(5-chloro-2-methoxyphenyl)pyridine-3-carboxamide (PubChem CID 4856255) has the molecular formula C13H9Cl3N2O2 and a molecular weight of 331.59 g/mol. Its IUPAC name is 5,6-dichloro-N-(5-chloro-2-methoxyphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name5,6-dichloro-N-(5-chloro-2-methoxyphenyl)pyridine-3-carboxamide
PubChem CID4856255
Molecular FormulaC13H9Cl3N2O2
Molecular Weight331.59 g/mol
Exact Mass329.97
IUPAC Name5,6-dichloro-N-(5-chloro-2-methoxyphenyl)pyridine-3-carboxamide
SMILESCOc1ccc(Cl)cc1NC(=O)c1cnc(Cl)c(Cl)c1
InChIInChI=1S/C13H9Cl3N2O2/c1-20-11-3-2-8(14)5-10(11)18-13(19)7-4-9(15)12(16)17-6-7/h2-6H,1H3,(H,18,19)
InChIKeyUCORRPCIYCBALM-UHFFFAOYSA-N
XLogP4.30
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.59
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

5,6-dichloro-N-[2-(5-chloro-2-methoxyanilino)-2-oxoethyl]-N-methylpyridine-3-carboxamide
CID 55329725
N-(5-chloro-2-methoxyphenyl)-1H-imidazo[4,5-b]pyridine-6-carboxamide
CID 110859642
N-(5-chloro-2-methoxyphenyl)-6-(ethylamino)pyridine-3-carboxamide
CID 62171907
6-(2-chloroanilino)-N-(5-chloro-2-methoxyphenyl)pyridine-3-carboxamide
CID 109163334
N-(5-chloro-2-methoxyphenyl)-4-iodobenzamide
CID 1047673
5-N-tert-butyl-3-N-(5-chloro-2-methoxyphenyl)pyridine-3,5-dicarboxamide
CID 109106946
6-amino-5-chloro-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide
CID 62153220
4-chloro-N-(5-chloro-2-methoxyphenyl)-3-iodobenzamide
CID 38886565
5,6-dichloro-N-(5-chloro-2-cyanophenyl)pyridine-3-carboxamide
CID 60628665
N-(5-chloro-2-methoxyphenyl)-6-(2-methoxyanilino)pyridine-3-carboxamide
CID 109163811
2-bromo-N-(5-chloro-2-methoxyphenyl)pyridine-4-carboxamide
CID 103751745
5-(4-chloroanilino)-N-(5-chloro-2-methoxyphenyl)pyridine-3-carboxamide
CID 109244615

Frequently Asked Questions

What is the IUPAC name of 5,6-dichloro-N-(5-chloro-2-methoxyphenyl)pyridine-3-carboxamide?
The IUPAC name of 5,6-dichloro-N-(5-chloro-2-methoxyphenyl)pyridine-3-carboxamide (CID 4856255) is 5,6-dichloro-N-(5-chloro-2-methoxyphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 5,6-dichloro-N-(5-chloro-2-methoxyphenyl)pyridine-3-carboxamide?
The canonical SMILES for 5,6-dichloro-N-(5-chloro-2-methoxyphenyl)pyridine-3-carboxamide is COc1ccc(Cl)cc1NC(=O)c1cnc(Cl)c(Cl)c1.
What is the InChIKey of 5,6-dichloro-N-(5-chloro-2-methoxyphenyl)pyridine-3-carboxamide?
The InChIKey is UCORRPCIYCBALM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9Cl3N2O2/c1-20-11-3-2-8(14)5-10(11)18-13(19)7-4-9(15)12(16)17-6-7/h2-6H,1H3,(H,18,19).
What are the key properties of 5,6-dichloro-N-(5-chloro-2-methoxyphenyl)pyridine-3-carboxamide?
5,6-dichloro-N-(5-chloro-2-methoxyphenyl)pyridine-3-carboxamide has a molecular weight of 331.59 g/mol, XLogP of 4.30, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dichloro-N-(5-chloro-2-methoxyphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 4856255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).