3-fluoro-N-(2-methyl-3-piperidin-1-ylpropyl)pyridine-4-carboxamide

C15H22FN3O — CID 115646380

IUPAC3-fluoro-N-(2-methyl-3-piperidin-1-ylpropyl)pyridine-4-carboxamide
SMILESCC(CNC(=O)c1ccncc1F)CN1CCCCC1
InChIInChI=1S/C15H22FN3O/c1-12(11-19-7-3-2-4-8-19)9-18-15(20)13-5-6-17-10-14(13)16/h5-6,10,12H,2-4,7-9,11H2,1H3,(H,18,20)
InChIKeyZMLBFCLXUUDKPC-UHFFFAOYSA-N
MW279.36 g/mol
LogP2.07
Rot. Bonds5

About 3-fluoro-N-(2-methyl-3-piperidin-1-ylpropyl)pyridine-4-carboxamide

3-fluoro-N-(2-methyl-3-piperidin-1-ylpropyl)pyridine-4-carboxamide (PubChem CID 115646380) has the molecular formula C15H22FN3O and a molecular weight of 279.36 g/mol. Its IUPAC name is 3-fluoro-N-(2-methyl-3-piperidin-1-ylpropyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name3-fluoro-N-(2-methyl-3-piperidin-1-ylpropyl)pyridine-4-carboxamide
PubChem CID115646380
Molecular FormulaC15H22FN3O
Molecular Weight279.36 g/mol
Exact Mass279.17
IUPAC Name3-fluoro-N-(2-methyl-3-piperidin-1-ylpropyl)pyridine-4-carboxamide
SMILESCC(CNC(=O)c1ccncc1F)CN1CCCCC1
InChIInChI=1S/C15H22FN3O/c1-12(11-19-7-3-2-4-8-19)9-18-15(20)13-5-6-17-10-14(13)16/h5-6,10,12H,2-4,7-9,11H2,1H3,(H,18,20)
InChIKeyZMLBFCLXUUDKPC-UHFFFAOYSA-N
XLogP2.07
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.36
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-fluoro-N-(2-methylbutyl)pyridine-4-carboxamide
CID 105066570
3-fluoro-N-[(2S)-2-phenyl-2-piperidin-1-ylethyl]pyridine-4-carboxamide
CID 99973037
2-fluoro-N-(2-methyl-3-piperidin-1-ylpropyl)pyridine-4-carboxamide
CID 61292554
2-chloro-N-(2-methyl-3-pyrrolidin-1-ylpropyl)furan-3-carboxamide
CID 106686782
2-amino-5-chloro-N-(2-methyl-3-piperidin-1-ylpropyl)benzamide
CID 61139853
3-fluoro-N-[2-(2-methylpropanoylamino)ethyl]pyridine-4-carboxamide
CID 115645511
5-chloro-2-hydroxy-N-(2-methyl-3-pyrrolidin-1-ylpropyl)benzamide
CID 47308839
2-bromo-N-(2-methyl-3-piperidin-1-ylpropyl)furan-3-carboxamide
CID 106853640
5-amino-2-bromo-4-fluoro-N-(2-methyl-3-pyrrolidin-1-ylpropyl)benzamide
CID 62992397
3-fluoro-4-methoxy-N-(2-methyl-3-piperidin-1-ylpropyl)benzamide
CID 86824610
1-(4-chlorophenyl)-N-(2-methyl-3-pyrrolidin-1-ylpropyl)-5-(trifluoromethyl)pyrazole-4-carboxamide
CID 55878361
6-hydrazinyl-N-(2-methyl-3-pyrrolidin-1-ylpropyl)pyridine-3-carboxamide
CID 62990482

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-(2-methyl-3-piperidin-1-ylpropyl)pyridine-4-carboxamide?
The IUPAC name of 3-fluoro-N-(2-methyl-3-piperidin-1-ylpropyl)pyridine-4-carboxamide (CID 115646380) is 3-fluoro-N-(2-methyl-3-piperidin-1-ylpropyl)pyridine-4-carboxamide.
What is the SMILES notation for 3-fluoro-N-(2-methyl-3-piperidin-1-ylpropyl)pyridine-4-carboxamide?
The canonical SMILES for 3-fluoro-N-(2-methyl-3-piperidin-1-ylpropyl)pyridine-4-carboxamide is CC(CNC(=O)c1ccncc1F)CN1CCCCC1.
What is the InChIKey of 3-fluoro-N-(2-methyl-3-piperidin-1-ylpropyl)pyridine-4-carboxamide?
The InChIKey is ZMLBFCLXUUDKPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22FN3O/c1-12(11-19-7-3-2-4-8-19)9-18-15(20)13-5-6-17-10-14(13)16/h5-6,10,12H,2-4,7-9,11H2,1H3,(H,18,20).
What are the key properties of 3-fluoro-N-(2-methyl-3-piperidin-1-ylpropyl)pyridine-4-carboxamide?
3-fluoro-N-(2-methyl-3-piperidin-1-ylpropyl)pyridine-4-carboxamide has a molecular weight of 279.36 g/mol, XLogP of 2.07, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-(2-methyl-3-piperidin-1-ylpropyl)pyridine-4-carboxamide is sourced from PubChem (CID 115646380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).