4-chloro-N-(4-chlorophenyl)-6-methylpyridine-3-carboxamide

C13H10Cl2N2O — CID 81225292

IUPAC4-chloro-N-(4-chlorophenyl)-6-methylpyridine-3-carboxamide
SMILESCc1cc(Cl)c(C(=O)Nc2ccc(Cl)cc2)cn1
InChIInChI=1S/C13H10Cl2N2O/c1-8-6-12(15)11(7-16-8)13(18)17-10-4-2-9(14)3-5-10/h2-7H,1H3,(H,17,18)
InChIKeyWVIPUZBRRSKOMD-UHFFFAOYSA-N
MW281.14 g/mol
LogP3.95
Rot. Bonds2

About 4-chloro-N-(4-chlorophenyl)-6-methylpyridine-3-carboxamide

4-chloro-N-(4-chlorophenyl)-6-methylpyridine-3-carboxamide (PubChem CID 81225292) has the molecular formula C13H10Cl2N2O and a molecular weight of 281.14 g/mol. Its IUPAC name is 4-chloro-N-(4-chlorophenyl)-6-methylpyridine-3-carboxamide.

Molecular Properties

Compound Name4-chloro-N-(4-chlorophenyl)-6-methylpyridine-3-carboxamide
PubChem CID81225292
Molecular FormulaC13H10Cl2N2O
Molecular Weight281.14 g/mol
Exact Mass280.02
IUPAC Name4-chloro-N-(4-chlorophenyl)-6-methylpyridine-3-carboxamide
SMILESCc1cc(Cl)c(C(=O)Nc2ccc(Cl)cc2)cn1
InChIInChI=1S/C13H10Cl2N2O/c1-8-6-12(15)11(7-16-8)13(18)17-10-4-2-9(14)3-5-10/h2-7H,1H3,(H,17,18)
InChIKeyWVIPUZBRRSKOMD-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

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Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(4-chlorophenyl)-6-methylpyridine-3-carboxamide?
The IUPAC name of 4-chloro-N-(4-chlorophenyl)-6-methylpyridine-3-carboxamide (CID 81225292) is 4-chloro-N-(4-chlorophenyl)-6-methylpyridine-3-carboxamide.
What is the SMILES notation for 4-chloro-N-(4-chlorophenyl)-6-methylpyridine-3-carboxamide?
The canonical SMILES for 4-chloro-N-(4-chlorophenyl)-6-methylpyridine-3-carboxamide is Cc1cc(Cl)c(C(=O)Nc2ccc(Cl)cc2)cn1.
What is the InChIKey of 4-chloro-N-(4-chlorophenyl)-6-methylpyridine-3-carboxamide?
The InChIKey is WVIPUZBRRSKOMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10Cl2N2O/c1-8-6-12(15)11(7-16-8)13(18)17-10-4-2-9(14)3-5-10/h2-7H,1H3,(H,17,18).
What are the key properties of 4-chloro-N-(4-chlorophenyl)-6-methylpyridine-3-carboxamide?
4-chloro-N-(4-chlorophenyl)-6-methylpyridine-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 4-chloro-N-(4-chlorophenyl)-6-methylpyridine-3-carboxamide is sourced from PubChem (CID 81225292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).