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

C12H10FN3O — CID 115645542

IUPAC3-fluoro-N-(6-methyl-2-pyridinyl)pyridine-4-carboxamide
SMILESCc1cccc(NC(=O)c2ccncc2F)n1
InChIInChI=1S/C12H10FN3O/c1-8-3-2-4-11(15-8)16-12(17)9-5-6-14-7-10(9)13/h2-7H,1H3,(H,15,16,17)
InChIKeyXBWISZSMGKURNI-UHFFFAOYSA-N
MW231.23 g/mol
LogP2.18
Rot. Bonds2

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

3-fluoro-N-(6-methyl-2-pyridinyl)pyridine-4-carboxamide (PubChem CID 115645542) has the molecular formula C12H10FN3O and a molecular weight of 231.23 g/mol. Its IUPAC name is 3-fluoro-N-(6-methyl-2-pyridinyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name3-fluoro-N-(6-methyl-2-pyridinyl)pyridine-4-carboxamide
PubChem CID115645542
Molecular FormulaC12H10FN3O
Molecular Weight231.23 g/mol
Exact Mass231.08
IUPAC Name3-fluoro-N-(6-methyl-2-pyridinyl)pyridine-4-carboxamide
SMILESCc1cccc(NC(=O)c2ccncc2F)n1
InChIInChI=1S/C12H10FN3O/c1-8-3-2-4-11(15-8)16-12(17)9-5-6-14-7-10(9)13/h2-7H,1H3,(H,15,16,17)
InChIKeyXBWISZSMGKURNI-UHFFFAOYSA-N
XLogP2.18
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.23
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-fluoro-N-[6-(3-hydroxyprop-1-ynyl)-2-pyridinyl]pyridine-4-carboxamide
CID 64951684
3-fluoro-N-(6-methyl-5-nitro-2-pyridinyl)pyridine-4-carboxamide
CID 71849348
3-fluoro-N-(5-methyl-1,2-oxazol-3-yl)pyridine-4-carboxamide
CID 115646253
N-(6-methyl-2-pyridinyl)-4-(propylamino)pyridine-3-carboxamide
CID 81235208
N-(2-amino-6-methylphenyl)-3-fluoropyridine-4-carboxamide
CID 64951439
3-fluoro-N-(6-propan-2-ylpyrazin-2-yl)pyridine-4-carboxamide
CID 146357330
3-fluoro-4-(4-methyl-3-pyridinyl)-N-(6-methyl-2-pyridinyl)pyridine-2-carboxamide
CID 171091243
4-chloro-6-methyl-N-(6-methyl-2-pyridinyl)pyridine-3-carboxamide
CID 81225554
N-(2-amino-6-fluorophenyl)-3-fluoropyridine-4-carboxamide
CID 81315197
2-fluoro-N-(6-methyl-2-pyridinyl)-3-(trifluoromethyl)benzamide
CID 79883704
3-fluoro-N-(4-sulfanylphenyl)pyridine-4-carboxamide
CID 129252405
3-fluoro-N-(5-methyl-3-pyridinyl)pyridine-4-carboxamide
CID 103738947

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-(6-methyl-2-pyridinyl)pyridine-4-carboxamide?
The IUPAC name of 3-fluoro-N-(6-methyl-2-pyridinyl)pyridine-4-carboxamide (CID 115645542) is 3-fluoro-N-(6-methyl-2-pyridinyl)pyridine-4-carboxamide.
What is the SMILES notation for 3-fluoro-N-(6-methyl-2-pyridinyl)pyridine-4-carboxamide?
The canonical SMILES for 3-fluoro-N-(6-methyl-2-pyridinyl)pyridine-4-carboxamide is Cc1cccc(NC(=O)c2ccncc2F)n1.
What is the InChIKey of 3-fluoro-N-(6-methyl-2-pyridinyl)pyridine-4-carboxamide?
The InChIKey is XBWISZSMGKURNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10FN3O/c1-8-3-2-4-11(15-8)16-12(17)9-5-6-14-7-10(9)13/h2-7H,1H3,(H,15,16,17).
What are the key properties of 3-fluoro-N-(6-methyl-2-pyridinyl)pyridine-4-carboxamide?
3-fluoro-N-(6-methyl-2-pyridinyl)pyridine-4-carboxamide has a molecular weight of 231.23 g/mol, XLogP of 2.18, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-(6-methyl-2-pyridinyl)pyridine-4-carboxamide is sourced from PubChem (CID 115645542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).