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

C13H9Cl2FN2O — CID 81225961

IUPAC4-chloro-N-(3-chloro-4-fluorophenyl)-6-methylpyridine-3-carboxamide
SMILESCc1cc(Cl)c(C(=O)Nc2ccc(F)c(Cl)c2)cn1
InChIInChI=1S/C13H9Cl2FN2O/c1-7-4-10(14)9(6-17-7)13(19)18-8-2-3-12(16)11(15)5-8/h2-6H,1H3,(H,18,19)
InChIKeyFTRDTWPQHFMHJW-UHFFFAOYSA-N
MW299.13 g/mol
LogP4.09
Rot. Bonds2

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

4-chloro-N-(3-chloro-4-fluorophenyl)-6-methylpyridine-3-carboxamide (PubChem CID 81225961) has the molecular formula C13H9Cl2FN2O and a molecular weight of 299.13 g/mol. Its IUPAC name is 4-chloro-N-(3-chloro-4-fluorophenyl)-6-methylpyridine-3-carboxamide.

Molecular Properties

Compound Name4-chloro-N-(3-chloro-4-fluorophenyl)-6-methylpyridine-3-carboxamide
PubChem CID81225961
Molecular FormulaC13H9Cl2FN2O
Molecular Weight299.13 g/mol
Exact Mass298.01
IUPAC Name4-chloro-N-(3-chloro-4-fluorophenyl)-6-methylpyridine-3-carboxamide
SMILESCc1cc(Cl)c(C(=O)Nc2ccc(F)c(Cl)c2)cn1
InChIInChI=1S/C13H9Cl2FN2O/c1-7-4-10(14)9(6-17-7)13(19)18-8-2-3-12(16)11(15)5-8/h2-6H,1H3,(H,18,19)
InChIKeyFTRDTWPQHFMHJW-UHFFFAOYSA-N
XLogP4.09
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.13
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-chloro-N-(4-chloro-3-fluorophenyl)-6-methylpyridine-3-carboxamide
CID 81226487
4-chloro-N-(4-chlorophenyl)-6-methylpyridine-3-carboxamide
CID 81225292
4-chloro-N-(3,5-dichloro-4-fluorophenyl)-6-methylpyridine-3-carboxamide
CID 106509693
N-(3-bromo-4-methylphenyl)-4-chloro-6-methylpyridine-3-carboxamide
CID 81226921
N-(3-chloro-4-fluorophenyl)-3-methylpyridine-4-carboxamide
CID 110859368
4-chloro-N-(3-iodo-4-methylphenyl)-6-methylpyridine-3-carboxamide
CID 81226857
N-(3-chloro-4-fluorophenyl)-2-methyl-6-oxo-1H-pyrimidine-5-carboxamide
CID 110859395
N-(3-acetamidophenyl)-4-chloro-6-methylpyridine-3-carboxamide
CID 81228962
4-chloro-N-(3-fluoro-5-methylphenyl)-6-methylpyridine-3-carboxamide
CID 81232937
4-chloro-N-(5-chloro-2-pyridinyl)-6-methylpyridine-3-carboxamide
CID 81225634
2-chloro-N-(3-chloro-4-fluorophenyl)-4-methylbenzamide
CID 885992
4-chloro-6-methyl-N-(3-propan-2-ylphenyl)pyridine-3-carboxamide
CID 81225795

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(3-chloro-4-fluorophenyl)-6-methylpyridine-3-carboxamide?
The IUPAC name of 4-chloro-N-(3-chloro-4-fluorophenyl)-6-methylpyridine-3-carboxamide (CID 81225961) is 4-chloro-N-(3-chloro-4-fluorophenyl)-6-methylpyridine-3-carboxamide.
What is the SMILES notation for 4-chloro-N-(3-chloro-4-fluorophenyl)-6-methylpyridine-3-carboxamide?
The canonical SMILES for 4-chloro-N-(3-chloro-4-fluorophenyl)-6-methylpyridine-3-carboxamide is Cc1cc(Cl)c(C(=O)Nc2ccc(F)c(Cl)c2)cn1.
What is the InChIKey of 4-chloro-N-(3-chloro-4-fluorophenyl)-6-methylpyridine-3-carboxamide?
The InChIKey is FTRDTWPQHFMHJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9Cl2FN2O/c1-7-4-10(14)9(6-17-7)13(19)18-8-2-3-12(16)11(15)5-8/h2-6H,1H3,(H,18,19).
What are the key properties of 4-chloro-N-(3-chloro-4-fluorophenyl)-6-methylpyridine-3-carboxamide?
4-chloro-N-(3-chloro-4-fluorophenyl)-6-methylpyridine-3-carboxamide has a molecular weight of 299.13 g/mol, XLogP of 4.09, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(3-chloro-4-fluorophenyl)-6-methylpyridine-3-carboxamide is sourced from PubChem (CID 81225961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).