5-fluoro-6-methyl-N-(4-methyl-3-pyridinyl)pyridine-2-carboxamide

C13H12FN3O — CID 146080352

IUPAC5-fluoro-6-methyl-N-(4-methyl-3-pyridinyl)pyridine-2-carboxamide
SMILESCc1ccncc1NC(=O)c1ccc(F)c(C)n1
InChIInChI=1S/C13H12FN3O/c1-8-5-6-15-7-12(8)17-13(18)11-4-3-10(14)9(2)16-11/h3-7H,1-2H3,(H,17,18)
InChIKeyIOEKMCLXTUHBTE-UHFFFAOYSA-N
MW245.26 g/mol
LogP2.48
Rot. Bonds2

About 5-fluoro-6-methyl-N-(4-methyl-3-pyridinyl)pyridine-2-carboxamide

5-fluoro-6-methyl-N-(4-methyl-3-pyridinyl)pyridine-2-carboxamide (PubChem CID 146080352) has the molecular formula C13H12FN3O and a molecular weight of 245.26 g/mol. Its IUPAC name is 5-fluoro-6-methyl-N-(4-methyl-3-pyridinyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-fluoro-6-methyl-N-(4-methyl-3-pyridinyl)pyridine-2-carboxamide
PubChem CID146080352
Molecular FormulaC13H12FN3O
Molecular Weight245.26 g/mol
Exact Mass245.10
IUPAC Name5-fluoro-6-methyl-N-(4-methyl-3-pyridinyl)pyridine-2-carboxamide
SMILESCc1ccncc1NC(=O)c1ccc(F)c(C)n1
InChIInChI=1S/C13H12FN3O/c1-8-5-6-15-7-12(8)17-13(18)11-4-3-10(14)9(2)16-11/h3-7H,1-2H3,(H,17,18)
InChIKeyIOEKMCLXTUHBTE-UHFFFAOYSA-N
XLogP2.48
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.26
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-chloro-N-(4-methyl-3-pyridinyl)pyridine-2-carboxamide
CID 63327625
2,6-difluoro-N-(4-methyl-3-pyridinyl)benzamide
CID 155976888
3,4,5-trifluoro-N-(4-methyl-3-pyridinyl)benzamide
CID 63327399
5-bromo-2-fluoro-N-(4-methyl-3-pyridinyl)benzamide
CID 63327503
6-(methylamino)-N-(4-methyl-3-pyridinyl)pyridazine-3-carboxamide
CID 55203049
1,3-bis(4-methyl-3-pyridinyl)urea
CID 86818735
5-fluoro-6-methyl-N-quinolin-5-ylpyridine-2-carboxamide
CID 146080713
2-fluoro-N-(4-methyl-3-pyridinyl)pyridine-4-carboxamide
CID 55203428
4-(4-chlorophenyl)-N-(4-methyl-3-pyridinyl)-1H-pyrrole-2-carboxamide
CID 166218692
N-(4-chloro-2-methylphenyl)-1,6-naphthyridine-2-carboxamide
CID 91064631
2-(4-chlorophenyl)-N-(4-methyl-3-pyridinyl)acetamide
CID 56826552
5-hydrazinyl-N-(4-methyl-3-pyridinyl)pyrazine-2-carboxamide
CID 107378263

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-6-methyl-N-(4-methyl-3-pyridinyl)pyridine-2-carboxamide?
The IUPAC name of 5-fluoro-6-methyl-N-(4-methyl-3-pyridinyl)pyridine-2-carboxamide (CID 146080352) is 5-fluoro-6-methyl-N-(4-methyl-3-pyridinyl)pyridine-2-carboxamide.
What is the SMILES notation for 5-fluoro-6-methyl-N-(4-methyl-3-pyridinyl)pyridine-2-carboxamide?
The canonical SMILES for 5-fluoro-6-methyl-N-(4-methyl-3-pyridinyl)pyridine-2-carboxamide is Cc1ccncc1NC(=O)c1ccc(F)c(C)n1.
What is the InChIKey of 5-fluoro-6-methyl-N-(4-methyl-3-pyridinyl)pyridine-2-carboxamide?
The InChIKey is IOEKMCLXTUHBTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12FN3O/c1-8-5-6-15-7-12(8)17-13(18)11-4-3-10(14)9(2)16-11/h3-7H,1-2H3,(H,17,18).
What are the key properties of 5-fluoro-6-methyl-N-(4-methyl-3-pyridinyl)pyridine-2-carboxamide?
5-fluoro-6-methyl-N-(4-methyl-3-pyridinyl)pyridine-2-carboxamide has a molecular weight of 245.26 g/mol, XLogP of 2.48, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-6-methyl-N-(4-methyl-3-pyridinyl)pyridine-2-carboxamide is sourced from PubChem (CID 146080352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).