1-[3-(2-fluorophenyl)-2-oxopropyl]-N-methylpiperidine-3-carboxamide

C16H21FN2O2 — CID 103196911

IUPAC1-[3-(2-fluorophenyl)-2-oxopropyl]-N-methylpiperidine-3-carboxamide
SMILESCNC(=O)C1CCCN(CC(=O)Cc2ccccc2F)C1
InChIInChI=1S/C16H21FN2O2/c1-18-16(21)13-6-4-8-19(10-13)11-14(20)9-12-5-2-3-7-15(12)17/h2-3,5,7,13H,4,6,8-11H2,1H3,(H,18,21)
InChIKeyWYOMEKDEFGMJIJ-UHFFFAOYSA-N
MW292.35 g/mol
LogP1.40
Rot. Bonds5

About 1-[3-(2-fluorophenyl)-2-oxopropyl]-N-methylpiperidine-3-carboxamide

1-[3-(2-fluorophenyl)-2-oxopropyl]-N-methylpiperidine-3-carboxamide (PubChem CID 103196911) has the molecular formula C16H21FN2O2 and a molecular weight of 292.35 g/mol. Its IUPAC name is 1-[3-(2-fluorophenyl)-2-oxopropyl]-N-methylpiperidine-3-carboxamide.

Molecular Properties

Compound Name1-[3-(2-fluorophenyl)-2-oxopropyl]-N-methylpiperidine-3-carboxamide
PubChem CID103196911
Molecular FormulaC16H21FN2O2
Molecular Weight292.35 g/mol
Exact Mass292.16
IUPAC Name1-[3-(2-fluorophenyl)-2-oxopropyl]-N-methylpiperidine-3-carboxamide
SMILESCNC(=O)C1CCCN(CC(=O)Cc2ccccc2F)C1
InChIInChI=1S/C16H21FN2O2/c1-18-16(21)13-6-4-8-19(10-13)11-14(20)9-12-5-2-3-7-15(12)17/h2-3,5,7,13H,4,6,8-11H2,1H3,(H,18,21)
InChIKeyWYOMEKDEFGMJIJ-UHFFFAOYSA-N
XLogP1.40
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.35
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(2-fluorophenyl)methyl]-N-methylpiperidine-3-carboxamide
CID 43918336
1-[(2-ethylphenyl)methyl]-N-methylpiperidine-3-carboxamide
CID 136534264
1-[2-(4-fluorophenyl)-2-oxoethyl]-N-methylpiperidine-3-carboxamide
CID 103196893
N-tert-butyl-1-[(2-fluorophenyl)methyl]piperidine-3-carboxamide
CID 43918466
N-methyl-1-[2-(2-methylphenyl)-2-oxoethyl]piperidine-3-carboxamide
CID 103196880
1-benzyl-N-methylpiperidine-3-carboxamide
CID 43918327
N-methyl-1-[2-(1-methylpyrrol-2-yl)-2-oxoethyl]piperidine-3-carboxamide
CID 113234331
1-[1-[(2-fluorophenyl)methyl]piperidin-3-yl]ethanone
CID 63846661
1-[(2-fluorophenyl)methyl]-N-pentan-2-ylpiperidine-3-carboxamide
CID 43924676
1-(2-fluorophenyl)-3-[4-(1-hydroxyethyl)piperidin-1-yl]propan-2-one
CID 106836569
N-benzhydryl-1-[(2-fluorophenyl)methyl]piperidine-3-carboxamide
CID 43925897
1-[(2-fluorophenyl)methyl]-N-(3-methoxyphenyl)piperidine-3-carboxamide
CID 43919659

Frequently Asked Questions

What is the IUPAC name of 1-[3-(2-fluorophenyl)-2-oxopropyl]-N-methylpiperidine-3-carboxamide?
The IUPAC name of 1-[3-(2-fluorophenyl)-2-oxopropyl]-N-methylpiperidine-3-carboxamide (CID 103196911) is 1-[3-(2-fluorophenyl)-2-oxopropyl]-N-methylpiperidine-3-carboxamide.
What is the SMILES notation for 1-[3-(2-fluorophenyl)-2-oxopropyl]-N-methylpiperidine-3-carboxamide?
The canonical SMILES for 1-[3-(2-fluorophenyl)-2-oxopropyl]-N-methylpiperidine-3-carboxamide is CNC(=O)C1CCCN(CC(=O)Cc2ccccc2F)C1.
What is the InChIKey of 1-[3-(2-fluorophenyl)-2-oxopropyl]-N-methylpiperidine-3-carboxamide?
The InChIKey is WYOMEKDEFGMJIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21FN2O2/c1-18-16(21)13-6-4-8-19(10-13)11-14(20)9-12-5-2-3-7-15(12)17/h2-3,5,7,13H,4,6,8-11H2,1H3,(H,18,21).
What are the key properties of 1-[3-(2-fluorophenyl)-2-oxopropyl]-N-methylpiperidine-3-carboxamide?
1-[3-(2-fluorophenyl)-2-oxopropyl]-N-methylpiperidine-3-carboxamide has a molecular weight of 292.35 g/mol, XLogP of 1.40, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(2-fluorophenyl)-2-oxopropyl]-N-methylpiperidine-3-carboxamide is sourced from PubChem (CID 103196911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).