3-fluoro-N-(5-methyl-2-pentan-3-ylpyrazol-3-yl)pyridine-4-carboxamide

C15H19FN4O — CID 50952644

IUPAC3-fluoro-N-(5-methyl-2-pentan-3-ylpyrazol-3-yl)pyridine-4-carboxamide
SMILESCCC(CC)n1nc(C)cc1NC(=O)c1ccncc1F
InChIInChI=1S/C15H19FN4O/c1-4-11(5-2)20-14(8-10(3)19-20)18-15(21)12-6-7-17-9-13(12)16/h6-9,11H,4-5H2,1-3H3,(H,18,21)
InChIKeyZAHCSWMYOFPKEH-UHFFFAOYSA-N
MW290.34 g/mol
LogP3.34
Rot. Bonds5

About 3-fluoro-N-(5-methyl-2-pentan-3-ylpyrazol-3-yl)pyridine-4-carboxamide

3-fluoro-N-(5-methyl-2-pentan-3-ylpyrazol-3-yl)pyridine-4-carboxamide (PubChem CID 50952644) has the molecular formula C15H19FN4O and a molecular weight of 290.34 g/mol. Its IUPAC name is 3-fluoro-N-(5-methyl-2-pentan-3-ylpyrazol-3-yl)pyridine-4-carboxamide.

Molecular Properties

Compound Name3-fluoro-N-(5-methyl-2-pentan-3-ylpyrazol-3-yl)pyridine-4-carboxamide
PubChem CID50952644
Molecular FormulaC15H19FN4O
Molecular Weight290.34 g/mol
Exact Mass290.15
IUPAC Name3-fluoro-N-(5-methyl-2-pentan-3-ylpyrazol-3-yl)pyridine-4-carboxamide
SMILESCCC(CC)n1nc(C)cc1NC(=O)c1ccncc1F
InChIInChI=1S/C15H19FN4O/c1-4-11(5-2)20-14(8-10(3)19-20)18-15(21)12-6-7-17-9-13(12)16/h6-9,11H,4-5H2,1-3H3,(H,18,21)
InChIKeyZAHCSWMYOFPKEH-UHFFFAOYSA-N
XLogP3.34
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.34
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-chloro-N-(5-methyl-2-pentan-3-ylpyrazol-3-yl)pyridine-4-carboxamide
CID 46992442
N-(5-methyl-2-pentan-3-ylpyrazol-3-yl)-2-pyridin-3-ylpyrimidine-5-carboxamide
CID 46993346
3-acetamido-N-(5-methyl-2-pentan-3-ylpyrazol-3-yl)thiophene-2-carboxamide
CID 50960014
3-fluoro-N-(5-methyl-3-pyridinyl)pyridine-4-carboxamide
CID 103738947
3-fluoro-N-(2-methylbutyl)pyridine-4-carboxamide
CID 105066570
(2S)-2-acetamido-N-(5-methyl-2-pentan-3-ylpyrazol-3-yl)propanamide
CID 46999276
3-fluoro-N-(5-methyl-1,2-oxazol-3-yl)pyridine-4-carboxamide
CID 115646253
3-fluoro-N-(6-methyl-2-pyridinyl)pyridine-4-carboxamide
CID 115645542
3-fluoro-N-[1-(2-hydroxyethyl)-3-thiophen-2-ylpyrazol-5-yl]pyridine-4-carboxamide
CID 111456737
N-(6-chloro-5-methyl-3-pyridinyl)-3-fluoropyridine-4-carboxamide
CID 103745275
(2,5-dimethylpyrazol-3-yl)-(3-fluoro-4-pyridinyl)methanone
CID 105129319
N-(3-amino-4-methylphenyl)-3-fluoropyridine-4-carboxamide
CID 64950847

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-(5-methyl-2-pentan-3-ylpyrazol-3-yl)pyridine-4-carboxamide?
The IUPAC name of 3-fluoro-N-(5-methyl-2-pentan-3-ylpyrazol-3-yl)pyridine-4-carboxamide (CID 50952644) is 3-fluoro-N-(5-methyl-2-pentan-3-ylpyrazol-3-yl)pyridine-4-carboxamide.
What is the SMILES notation for 3-fluoro-N-(5-methyl-2-pentan-3-ylpyrazol-3-yl)pyridine-4-carboxamide?
The canonical SMILES for 3-fluoro-N-(5-methyl-2-pentan-3-ylpyrazol-3-yl)pyridine-4-carboxamide is CCC(CC)n1nc(C)cc1NC(=O)c1ccncc1F.
What is the InChIKey of 3-fluoro-N-(5-methyl-2-pentan-3-ylpyrazol-3-yl)pyridine-4-carboxamide?
The InChIKey is ZAHCSWMYOFPKEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19FN4O/c1-4-11(5-2)20-14(8-10(3)19-20)18-15(21)12-6-7-17-9-13(12)16/h6-9,11H,4-5H2,1-3H3,(H,18,21).
What are the key properties of 3-fluoro-N-(5-methyl-2-pentan-3-ylpyrazol-3-yl)pyridine-4-carboxamide?
3-fluoro-N-(5-methyl-2-pentan-3-ylpyrazol-3-yl)pyridine-4-carboxamide has a molecular weight of 290.34 g/mol, XLogP of 3.34, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-(5-methyl-2-pentan-3-ylpyrazol-3-yl)pyridine-4-carboxamide is sourced from PubChem (CID 50952644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).