3-fluoro-N-(1-methylcyclopentyl)-2-(propylamino)pyridine-4-carboxamide

C15H22FN3O — CID 105386620

IUPAC3-fluoro-N-(1-methylcyclopentyl)-2-(propylamino)pyridine-4-carboxamide
SMILESCCCNc1nccc(C(=O)NC2(C)CCCC2)c1F
InChIInChI=1S/C15H22FN3O/c1-3-9-17-13-12(16)11(6-10-18-13)14(20)19-15(2)7-4-5-8-15/h6,10H,3-5,7-9H2,1-2H3,(H,17,18)(H,19,20)
InChIKeyHZQCEMRJVGGMJD-UHFFFAOYSA-N
MW279.36 g/mol
LogP3.11
Rot. Bonds5

About 3-fluoro-N-(1-methylcyclopentyl)-2-(propylamino)pyridine-4-carboxamide

3-fluoro-N-(1-methylcyclopentyl)-2-(propylamino)pyridine-4-carboxamide (PubChem CID 105386620) has the molecular formula C15H22FN3O and a molecular weight of 279.36 g/mol. Its IUPAC name is 3-fluoro-N-(1-methylcyclopentyl)-2-(propylamino)pyridine-4-carboxamide.

Molecular Properties

Compound Name3-fluoro-N-(1-methylcyclopentyl)-2-(propylamino)pyridine-4-carboxamide
PubChem CID105386620
Molecular FormulaC15H22FN3O
Molecular Weight279.36 g/mol
Exact Mass279.17
IUPAC Name3-fluoro-N-(1-methylcyclopentyl)-2-(propylamino)pyridine-4-carboxamide
SMILESCCCNc1nccc(C(=O)NC2(C)CCCC2)c1F
InChIInChI=1S/C15H22FN3O/c1-3-9-17-13-12(16)11(6-10-18-13)14(20)19-15(2)7-4-5-8-15/h6,10H,3-5,7-9H2,1-2H3,(H,17,18)(H,19,20)
InChIKeyHZQCEMRJVGGMJD-UHFFFAOYSA-N
XLogP3.11
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.36
LogP ≤ 53.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2,3-difluoro-N-(1-methylcyclopentyl)pyridine-4-carboxamide
CID 105381019
3-fluoro-2-(propylamino)-N-(2,2,2-trifluoroethyl)pyridine-4-carboxamide
CID 105384157
N-(1-cyclobutylethyl)-3-fluoro-2-(propylamino)pyridine-4-carboxamide
CID 105387527
N-(cyclohexylmethyl)-3-fluoro-2-(propylamino)pyridine-4-carboxamide
CID 105384839
N-(2-cyclopropylpropyl)-3-fluoro-2-(propylamino)pyridine-4-carboxamide
CID 105387388
N-[2-(ethylamino)-2-oxoethyl]-3-fluoro-2-(propylamino)pyridine-4-carboxamide
CID 105384867
N-(1-methylcyclopentyl)-4-(propylamino)pyridine-3-carboxamide
CID 81245301
3-fluoro-N-hexan-3-yl-2-(propylamino)pyridine-4-carboxamide
CID 105385116
3-fluoro-N-(1-methylcyclohexyl)-2-(propylamino)benzamide
CID 63499533
3-fluoro-N-(2-methylsulfinylethyl)-2-(propylamino)pyridine-4-carboxamide
CID 105387416
N-[4-(dimethylamino)butan-2-yl]-3-fluoro-2-(propylamino)pyridine-4-carboxamide
CID 105385716
3-fluoro-N-(2-methyl-4-pyridinyl)-2-(propylamino)pyridine-4-carboxamide
CID 105386819

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-(1-methylcyclopentyl)-2-(propylamino)pyridine-4-carboxamide?
The IUPAC name of 3-fluoro-N-(1-methylcyclopentyl)-2-(propylamino)pyridine-4-carboxamide (CID 105386620) is 3-fluoro-N-(1-methylcyclopentyl)-2-(propylamino)pyridine-4-carboxamide.
What is the SMILES notation for 3-fluoro-N-(1-methylcyclopentyl)-2-(propylamino)pyridine-4-carboxamide?
The canonical SMILES for 3-fluoro-N-(1-methylcyclopentyl)-2-(propylamino)pyridine-4-carboxamide is CCCNc1nccc(C(=O)NC2(C)CCCC2)c1F.
What is the InChIKey of 3-fluoro-N-(1-methylcyclopentyl)-2-(propylamino)pyridine-4-carboxamide?
The InChIKey is HZQCEMRJVGGMJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22FN3O/c1-3-9-17-13-12(16)11(6-10-18-13)14(20)19-15(2)7-4-5-8-15/h6,10H,3-5,7-9H2,1-2H3,(H,17,18)(H,19,20).
What are the key properties of 3-fluoro-N-(1-methylcyclopentyl)-2-(propylamino)pyridine-4-carboxamide?
3-fluoro-N-(1-methylcyclopentyl)-2-(propylamino)pyridine-4-carboxamide has a molecular weight of 279.36 g/mol, XLogP of 3.11, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-(1-methylcyclopentyl)-2-(propylamino)pyridine-4-carboxamide is sourced from PubChem (CID 105386620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).