5-chloro-N-(4-fluorophenyl)-6-(methylamino)pyridine-3-carboxamide

C13H11ClFN3O — CID 62167429

IUPAC5-chloro-N-(4-fluorophenyl)-6-(methylamino)pyridine-3-carboxamide
SMILESCNc1ncc(C(=O)Nc2ccc(F)cc2)cc1Cl
InChIInChI=1S/C13H11ClFN3O/c1-16-12-11(14)6-8(7-17-12)13(19)18-10-4-2-9(15)3-5-10/h2-7H,1H3,(H,16,17)(H,18,19)
InChIKeyQGMKFXPMKNGRAO-UHFFFAOYSA-N
MW279.70 g/mol
LogP3.17
Rot. Bonds3

About 5-chloro-N-(4-fluorophenyl)-6-(methylamino)pyridine-3-carboxamide

5-chloro-N-(4-fluorophenyl)-6-(methylamino)pyridine-3-carboxamide (PubChem CID 62167429) has the molecular formula C13H11ClFN3O and a molecular weight of 279.70 g/mol. Its IUPAC name is 5-chloro-N-(4-fluorophenyl)-6-(methylamino)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-chloro-N-(4-fluorophenyl)-6-(methylamino)pyridine-3-carboxamide
PubChem CID62167429
Molecular FormulaC13H11ClFN3O
Molecular Weight279.70 g/mol
Exact Mass279.06
IUPAC Name5-chloro-N-(4-fluorophenyl)-6-(methylamino)pyridine-3-carboxamide
SMILESCNc1ncc(C(=O)Nc2ccc(F)cc2)cc1Cl
InChIInChI=1S/C13H11ClFN3O/c1-16-12-11(14)6-8(7-17-12)13(19)18-10-4-2-9(15)3-5-10/h2-7H,1H3,(H,16,17)(H,18,19)
InChIKeyQGMKFXPMKNGRAO-UHFFFAOYSA-N
XLogP3.17
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.70
LogP ≤ 53.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-chloro-N-(4-chloro-3-fluorophenyl)-6-(methylamino)pyridine-3-carboxamide
CID 62176655
5-chloro-N-(4-iodophenyl)-6-(methylamino)pyridine-3-carboxamide
CID 62166490
5-chloro-N-(2-chloro-4-fluorophenyl)-6-(methylamino)pyridine-3-carboxamide
CID 62166998
5-chloro-N-(3,5-dichlorophenyl)-6-(methylamino)pyridine-3-carboxamide
CID 62172945
5-chloro-N-[(4-fluorophenyl)methyl]-6-(methylamino)pyridine-3-carboxamide
CID 62167616
5-chloro-N-(4-fluoro-2-methoxyphenyl)-6-(methylamino)pyridine-3-carboxamide
CID 62175694
5-chloro-6-(methylamino)-N-pyridin-3-ylpyridine-3-carboxamide
CID 62172922
5-chloro-N-(3-fluoro-4-pyridinyl)-6-(methylamino)pyridine-3-carboxamide
CID 107595440
5-chloro-6-(methylamino)-N-pyrimidin-2-ylpyridine-3-carboxamide
CID 62172629
5-chloro-N-(2-chloro-4-iodophenyl)-6-(methylamino)pyridine-3-carboxamide
CID 107606074
N-(5-bromo-2-chlorophenyl)-5-chloro-6-(methylamino)pyridine-3-carboxamide
CID 62909137
5-chloro-N-(2,3-dimethylphenyl)-6-(methylamino)pyridine-3-carboxamide
CID 62165739

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(4-fluorophenyl)-6-(methylamino)pyridine-3-carboxamide?
The IUPAC name of 5-chloro-N-(4-fluorophenyl)-6-(methylamino)pyridine-3-carboxamide (CID 62167429) is 5-chloro-N-(4-fluorophenyl)-6-(methylamino)pyridine-3-carboxamide.
What is the SMILES notation for 5-chloro-N-(4-fluorophenyl)-6-(methylamino)pyridine-3-carboxamide?
The canonical SMILES for 5-chloro-N-(4-fluorophenyl)-6-(methylamino)pyridine-3-carboxamide is CNc1ncc(C(=O)Nc2ccc(F)cc2)cc1Cl.
What is the InChIKey of 5-chloro-N-(4-fluorophenyl)-6-(methylamino)pyridine-3-carboxamide?
The InChIKey is QGMKFXPMKNGRAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11ClFN3O/c1-16-12-11(14)6-8(7-17-12)13(19)18-10-4-2-9(15)3-5-10/h2-7H,1H3,(H,16,17)(H,18,19).
What are the key properties of 5-chloro-N-(4-fluorophenyl)-6-(methylamino)pyridine-3-carboxamide?
5-chloro-N-(4-fluorophenyl)-6-(methylamino)pyridine-3-carboxamide has a molecular weight of 279.70 g/mol, XLogP of 3.17, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(4-fluorophenyl)-6-(methylamino)pyridine-3-carboxamide is sourced from PubChem (CID 62167429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).