5-fluoro-N-[1-(furan-2-carbonyl)piperidin-4-yl]pyridine-3-carboxamide

C16H16FN3O3 — CID 136514589

IUPAC5-fluoro-N-[1-(furan-2-carbonyl)piperidin-4-yl]pyridine-3-carboxamide
SMILESO=C(NC1CCN(C(=O)c2ccco2)CC1)c1cncc(F)c1
InChIInChI=1S/C16H16FN3O3/c17-12-8-11(9-18-10-12)15(21)19-13-3-5-20(6-4-13)16(22)14-2-1-7-23-14/h1-2,7-10,13H,3-6H2,(H,19,21)
InChIKeyWDPTWSIYRNSZMO-UHFFFAOYSA-N
MW317.32 g/mol
LogP1.85
Rot. Bonds3

About 5-fluoro-N-[1-(furan-2-carbonyl)piperidin-4-yl]pyridine-3-carboxamide

5-fluoro-N-[1-(furan-2-carbonyl)piperidin-4-yl]pyridine-3-carboxamide (PubChem CID 136514589) has the molecular formula C16H16FN3O3 and a molecular weight of 317.32 g/mol. Its IUPAC name is 5-fluoro-N-[1-(furan-2-carbonyl)piperidin-4-yl]pyridine-3-carboxamide.

Molecular Properties

Compound Name5-fluoro-N-[1-(furan-2-carbonyl)piperidin-4-yl]pyridine-3-carboxamide
PubChem CID136514589
Molecular FormulaC16H16FN3O3
Molecular Weight317.32 g/mol
Exact Mass317.12
IUPAC Name5-fluoro-N-[1-(furan-2-carbonyl)piperidin-4-yl]pyridine-3-carboxamide
SMILESO=C(NC1CCN(C(=O)c2ccco2)CC1)c1cncc(F)c1
InChIInChI=1S/C16H16FN3O3/c17-12-8-11(9-18-10-12)15(21)19-13-3-5-20(6-4-13)16(22)14-2-1-7-23-14/h1-2,7-10,13H,3-6H2,(H,19,21)
InChIKeyWDPTWSIYRNSZMO-UHFFFAOYSA-N
XLogP1.85
TPSA75.44 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.32
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(furan-2-carbonyl)piperidin-4-yl]-4-methylbenzamide
CID 16613592
5-(4-fluorophenyl)-N-[1-(furan-2-carbonyl)piperidin-4-yl]-1H-pyrazole-4-carboxamide
CID 16613697
N-[1-(furan-2-carbonyl)piperidin-4-yl]-3,5-dinitrobenzamide
CID 134000280
2-[[1-(furan-2-carbonyl)piperidin-4-yl]carbamoyl]benzoic acid
CID 113083174
2-chloro-N-[1-(furan-2-carbonyl)piperidin-4-yl]benzamide
CID 46420508
N-[1-(furan-2-carbonyl)piperidin-4-yl]imidazo[1,2-a]pyridine-6-carboxamide
CID 167859792
1-(3-fluoro-4-pyridinyl)-3-[1-(furan-2-carbonyl)piperidin-4-yl]urea
CID 86791229
1-(4-fluorophenyl)-N-[1-(furan-2-carbonyl)piperidin-4-yl]-3,5-dimethylpyrazole-4-carboxamide
CID 134000355
N-[1-(furan-2-carbonyl)piperidin-4-yl]-4-phenylmethoxybenzamide
CID 16606665
3-benzamido-N-[1-(furan-2-carbonyl)piperidin-4-yl]-4-methylbenzamide
CID 55634715
3-[(3,4-difluorobenzoyl)amino]-N-[1-(furan-2-carbonyl)piperidin-4-yl]pyrazine-2-carboxamide
CID 42866708
4,5-dichloro-N-[1-(furan-2-carbonyl)piperidin-4-yl]-1H-pyrrole-2-carboxamide
CID 78836748

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-N-[1-(furan-2-carbonyl)piperidin-4-yl]pyridine-3-carboxamide?
The IUPAC name of 5-fluoro-N-[1-(furan-2-carbonyl)piperidin-4-yl]pyridine-3-carboxamide (CID 136514589) is 5-fluoro-N-[1-(furan-2-carbonyl)piperidin-4-yl]pyridine-3-carboxamide.
What is the SMILES notation for 5-fluoro-N-[1-(furan-2-carbonyl)piperidin-4-yl]pyridine-3-carboxamide?
The canonical SMILES for 5-fluoro-N-[1-(furan-2-carbonyl)piperidin-4-yl]pyridine-3-carboxamide is O=C(NC1CCN(C(=O)c2ccco2)CC1)c1cncc(F)c1.
What is the InChIKey of 5-fluoro-N-[1-(furan-2-carbonyl)piperidin-4-yl]pyridine-3-carboxamide?
The InChIKey is WDPTWSIYRNSZMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16FN3O3/c17-12-8-11(9-18-10-12)15(21)19-13-3-5-20(6-4-13)16(22)14-2-1-7-23-14/h1-2,7-10,13H,3-6H2,(H,19,21).
What are the key properties of 5-fluoro-N-[1-(furan-2-carbonyl)piperidin-4-yl]pyridine-3-carboxamide?
5-fluoro-N-[1-(furan-2-carbonyl)piperidin-4-yl]pyridine-3-carboxamide has a molecular weight of 317.32 g/mol, XLogP of 1.85, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-N-[1-(furan-2-carbonyl)piperidin-4-yl]pyridine-3-carboxamide is sourced from PubChem (CID 136514589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).