3-fluoro-N-(6-propan-2-ylpyrazin-2-yl)pyridine-4-carboxamide

C13H13FN4O — CID 146357330

IUPAC3-fluoro-N-(6-propan-2-ylpyrazin-2-yl)pyridine-4-carboxamide
SMILESCC(C)c1cncc(NC(=O)c2ccncc2F)n1
InChIInChI=1S/C13H13FN4O/c1-8(2)11-6-16-7-12(17-11)18-13(19)9-3-4-15-5-10(9)14/h3-8H,1-2H3,(H,17,18,19)
InChIKeyQWPFYQFYHKRJDC-UHFFFAOYSA-N
MW260.27 g/mol
LogP2.39
Rot. Bonds3

About 3-fluoro-N-(6-propan-2-ylpyrazin-2-yl)pyridine-4-carboxamide

3-fluoro-N-(6-propan-2-ylpyrazin-2-yl)pyridine-4-carboxamide (PubChem CID 146357330) has the molecular formula C13H13FN4O and a molecular weight of 260.27 g/mol. Its IUPAC name is 3-fluoro-N-(6-propan-2-ylpyrazin-2-yl)pyridine-4-carboxamide.

Molecular Properties

Compound Name3-fluoro-N-(6-propan-2-ylpyrazin-2-yl)pyridine-4-carboxamide
PubChem CID146357330
Molecular FormulaC13H13FN4O
Molecular Weight260.27 g/mol
Exact Mass260.11
IUPAC Name3-fluoro-N-(6-propan-2-ylpyrazin-2-yl)pyridine-4-carboxamide
SMILESCC(C)c1cncc(NC(=O)c2ccncc2F)n1
InChIInChI=1S/C13H13FN4O/c1-8(2)11-6-16-7-12(17-11)18-13(19)9-3-4-15-5-10(9)14/h3-8H,1-2H3,(H,17,18,19)
InChIKeyQWPFYQFYHKRJDC-UHFFFAOYSA-N
XLogP2.39
TPSA67.77 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.27
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-fluoro-N-(6-methyl-2-pyridinyl)pyridine-4-carboxamide
CID 115645542
3-fluoro-N-(5-methyl-1,2-oxazol-3-yl)pyridine-4-carboxamide
CID 115646253
1-(3-fluoro-4-pyridinyl)-2-hydroxy-3-methylbutan-1-one
CID 103455294
3-fluoro-N-(4-propan-2-yloxyphenyl)pyridine-4-carboxamide
CID 115645942
3-fluoro-N-(5-methyl-3-pyridinyl)pyridine-4-carboxamide
CID 103738947
3-fluoro-N-[4-[1-(methylamino)ethyl]phenyl]pyridine-4-carboxamide
CID 64950472
3-fluoro-N-(6-methyl-5-nitro-2-pyridinyl)pyridine-4-carboxamide
CID 71849348
3-fluoro-N-[2-(2-methylpropanoylamino)ethyl]pyridine-4-carboxamide
CID 115645511
N-(1-cyclobutylethyl)-3-fluoropyridine-4-carboxamide
CID 115769013
N-(5-cyano-2-pyridinyl)-3-fluoropyridine-4-carboxamide
CID 64949685
N-(5-bromopentan-2-yl)-3-fluoropyridine-4-carboxamide
CID 114316575
N-[1-(dimethylamino)-3-methylbutan-2-yl]-3-fluoropyridine-4-carboxamide
CID 115646512

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-(6-propan-2-ylpyrazin-2-yl)pyridine-4-carboxamide?
The IUPAC name of 3-fluoro-N-(6-propan-2-ylpyrazin-2-yl)pyridine-4-carboxamide (CID 146357330) is 3-fluoro-N-(6-propan-2-ylpyrazin-2-yl)pyridine-4-carboxamide.
What is the SMILES notation for 3-fluoro-N-(6-propan-2-ylpyrazin-2-yl)pyridine-4-carboxamide?
The canonical SMILES for 3-fluoro-N-(6-propan-2-ylpyrazin-2-yl)pyridine-4-carboxamide is CC(C)c1cncc(NC(=O)c2ccncc2F)n1.
What is the InChIKey of 3-fluoro-N-(6-propan-2-ylpyrazin-2-yl)pyridine-4-carboxamide?
The InChIKey is QWPFYQFYHKRJDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13FN4O/c1-8(2)11-6-16-7-12(17-11)18-13(19)9-3-4-15-5-10(9)14/h3-8H,1-2H3,(H,17,18,19).
What are the key properties of 3-fluoro-N-(6-propan-2-ylpyrazin-2-yl)pyridine-4-carboxamide?
3-fluoro-N-(6-propan-2-ylpyrazin-2-yl)pyridine-4-carboxamide has a molecular weight of 260.27 g/mol, XLogP of 2.39, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-(6-propan-2-ylpyrazin-2-yl)pyridine-4-carboxamide is sourced from PubChem (CID 146357330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).