6-[(3S)-1-acetylpiperidin-3-yl]-N-(3-fluorophenyl)pyridine-3-carboxamide

C19H20FN3O2 — CID 95825978

IUPAC6-[(3S)-1-acetylpiperidin-3-yl]-N-(3-fluorophenyl)pyridine-3-carboxamide
SMILESCC(=O)N1CCC[C@H](c2ccc(C(=O)Nc3cccc(F)c3)cn2)C1
InChIInChI=1S/C19H20FN3O2/c1-13(24)23-9-3-4-15(12-23)18-8-7-14(11-21-18)19(25)22-17-6-2-5-16(20)10-17/h2,5-8,10-11,15H,3-4,9,12H2,1H3,(H,22,25)/t15-/m0/s1
InChIKeyVIRZOBZIPXLKQT-HNNXBMFYSA-N
MW341.39 g/mol
LogP3.20
Rot. Bonds3

About 6-[(3S)-1-acetylpiperidin-3-yl]-N-(3-fluorophenyl)pyridine-3-carboxamide

6-[(3S)-1-acetylpiperidin-3-yl]-N-(3-fluorophenyl)pyridine-3-carboxamide (PubChem CID 95825978) has the molecular formula C19H20FN3O2 and a molecular weight of 341.39 g/mol. Its IUPAC name is 6-[(3S)-1-acetylpiperidin-3-yl]-N-(3-fluorophenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-[(3S)-1-acetylpiperidin-3-yl]-N-(3-fluorophenyl)pyridine-3-carboxamide
PubChem CID95825978
Molecular FormulaC19H20FN3O2
Molecular Weight341.39 g/mol
Exact Mass341.15
IUPAC Name6-[(3S)-1-acetylpiperidin-3-yl]-N-(3-fluorophenyl)pyridine-3-carboxamide
SMILESCC(=O)N1CCC[C@H](c2ccc(C(=O)Nc3cccc(F)c3)cn2)C1
InChIInChI=1S/C19H20FN3O2/c1-13(24)23-9-3-4-15(12-23)18-8-7-14(11-21-18)19(25)22-17-6-2-5-16(20)10-17/h2,5-8,10-11,15H,3-4,9,12H2,1H3,(H,22,25)/t15-/m0/s1
InChIKeyVIRZOBZIPXLKQT-HNNXBMFYSA-N
XLogP3.20
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.39
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[3-[5-(pyrrolidine-1-carbonyl)-2-pyridinyl]piperidin-1-yl]ethanone
CID 110090089
(3S)-1-acetyl-N-(3-fluorophenyl)piperidine-3-carboxamide
CID 9068167
3-[6-(1-acetylpiperidin-3-yl)-3-pyridinyl]benzoic acid
CID 110112133
N-(4-fluorophenyl)-6-[1-[2-(methanesulfonamido)acetyl]piperidin-3-yl]pyridine-3-carboxamide
CID 110264257
1-[3-[4-[(1-acetylpiperidin-3-yl)amino]-6-(3-fluoroanilino)pyrimidin-2-yl]piperidin-1-yl]ethanone
CID 167370371
6-[(3R,5S)-3,5-dimethylpiperazin-1-yl]-N-(3-fluorophenyl)pyridine-3-carboxamide
CID 146153254
6-[1-[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]piperidin-3-yl]-N-(4-fluorophenyl)pyridine-3-carboxamide
CID 110264285
N-(3-fluorophenyl)-5-[1-(4-methylbenzoyl)piperidin-3-yl]-1,3,4-thiadiazole-2-carboxamide
CID 50817252
1-[(3R)-3-[5-(2-methylphenyl)-2-pyridinyl]piperidin-1-yl]ethanone
CID 95825074
1-[(3R)-3-[5-(4-chlorophenyl)-2-pyridinyl]piperidin-1-yl]ethanone
CID 95825184
5-[1-(cyclopropanecarbonyl)piperidin-3-yl]-N-(3-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide
CID 50817188
1-[(3S)-3-[5-(5-methyl-1,3-thiazol-2-yl)-2-pyridinyl]piperidin-1-yl]ethanone
CID 124959024

Frequently Asked Questions

What is the IUPAC name of 6-[(3S)-1-acetylpiperidin-3-yl]-N-(3-fluorophenyl)pyridine-3-carboxamide?
The IUPAC name of 6-[(3S)-1-acetylpiperidin-3-yl]-N-(3-fluorophenyl)pyridine-3-carboxamide (CID 95825978) is 6-[(3S)-1-acetylpiperidin-3-yl]-N-(3-fluorophenyl)pyridine-3-carboxamide.
What is the SMILES notation for 6-[(3S)-1-acetylpiperidin-3-yl]-N-(3-fluorophenyl)pyridine-3-carboxamide?
The canonical SMILES for 6-[(3S)-1-acetylpiperidin-3-yl]-N-(3-fluorophenyl)pyridine-3-carboxamide is CC(=O)N1CCC[C@H](c2ccc(C(=O)Nc3cccc(F)c3)cn2)C1.
What is the InChIKey of 6-[(3S)-1-acetylpiperidin-3-yl]-N-(3-fluorophenyl)pyridine-3-carboxamide?
The InChIKey is VIRZOBZIPXLKQT-HNNXBMFYSA-N. The full InChI is InChI=1S/C19H20FN3O2/c1-13(24)23-9-3-4-15(12-23)18-8-7-14(11-21-18)19(25)22-17-6-2-5-16(20)10-17/h2,5-8,10-11,15H,3-4,9,12H2,1H3,(H,22,25)/t15-/m0/s1.
What are the key properties of 6-[(3S)-1-acetylpiperidin-3-yl]-N-(3-fluorophenyl)pyridine-3-carboxamide?
6-[(3S)-1-acetylpiperidin-3-yl]-N-(3-fluorophenyl)pyridine-3-carboxamide has a molecular weight of 341.39 g/mol, XLogP of 3.20, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(3S)-1-acetylpiperidin-3-yl]-N-(3-fluorophenyl)pyridine-3-carboxamide is sourced from PubChem (CID 95825978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).