N-(2-fluoro-5-methylphenyl)-6-oxo-3-phenylpiperidine-3-carboxamide

C19H19FN2O2 — CID 122134413

IUPACN-(2-fluoro-5-methylphenyl)-6-oxo-3-phenylpiperidine-3-carboxamide
SMILESCc1ccc(F)c(NC(=O)C2(c3ccccc3)CCC(=O)NC2)c1
InChIInChI=1S/C19H19FN2O2/c1-13-7-8-15(20)16(11-13)22-18(24)19(10-9-17(23)21-12-19)14-5-3-2-4-6-14/h2-8,11H,9-10,12H2,1H3,(H,21,23)(H,22,24)
InChIKeyNBMONUOFDXUCFD-UHFFFAOYSA-N
MW326.37 g/mol
LogP2.92
Rot. Bonds3

About N-(2-fluoro-5-methylphenyl)-6-oxo-3-phenylpiperidine-3-carboxamide

N-(2-fluoro-5-methylphenyl)-6-oxo-3-phenylpiperidine-3-carboxamide (PubChem CID 122134413) has the molecular formula C19H19FN2O2 and a molecular weight of 326.37 g/mol. Its IUPAC name is N-(2-fluoro-5-methylphenyl)-6-oxo-3-phenylpiperidine-3-carboxamide.

Molecular Properties

Compound NameN-(2-fluoro-5-methylphenyl)-6-oxo-3-phenylpiperidine-3-carboxamide
PubChem CID122134413
Molecular FormulaC19H19FN2O2
Molecular Weight326.37 g/mol
Exact Mass326.14
IUPAC NameN-(2-fluoro-5-methylphenyl)-6-oxo-3-phenylpiperidine-3-carboxamide
SMILESCc1ccc(F)c(NC(=O)C2(c3ccccc3)CCC(=O)NC2)c1
InChIInChI=1S/C19H19FN2O2/c1-13-7-8-15(20)16(11-13)22-18(24)19(10-9-17(23)21-12-19)14-5-3-2-4-6-14/h2-8,11H,9-10,12H2,1H3,(H,21,23)(H,22,24)
InChIKeyNBMONUOFDXUCFD-UHFFFAOYSA-N
XLogP2.92
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.37
LogP ≤ 52.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(6-oxo-3-phenylpiperidine-3-carbonyl)amino]quinoline-4-carboxamide
CID 154850128
(2-fluoro-5-methylphenyl)-(1-phenylcyclopropyl)methanone
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N-(2-fluoro-5-methylphenyl)-1-[(Z)-N'-hydroxycarbamimidoyl]cyclobutane-1-carboxamide
CID 80596684
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2-[2-(2-fluoro-5-methylanilino)-2-oxoethyl]-1,3-dihydroindene-2-carboxylic acid
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Frequently Asked Questions

What is the IUPAC name of N-(2-fluoro-5-methylphenyl)-6-oxo-3-phenylpiperidine-3-carboxamide?
The IUPAC name of N-(2-fluoro-5-methylphenyl)-6-oxo-3-phenylpiperidine-3-carboxamide (CID 122134413) is N-(2-fluoro-5-methylphenyl)-6-oxo-3-phenylpiperidine-3-carboxamide.
What is the SMILES notation for N-(2-fluoro-5-methylphenyl)-6-oxo-3-phenylpiperidine-3-carboxamide?
The canonical SMILES for N-(2-fluoro-5-methylphenyl)-6-oxo-3-phenylpiperidine-3-carboxamide is Cc1ccc(F)c(NC(=O)C2(c3ccccc3)CCC(=O)NC2)c1.
What is the InChIKey of N-(2-fluoro-5-methylphenyl)-6-oxo-3-phenylpiperidine-3-carboxamide?
The InChIKey is NBMONUOFDXUCFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19FN2O2/c1-13-7-8-15(20)16(11-13)22-18(24)19(10-9-17(23)21-12-19)14-5-3-2-4-6-14/h2-8,11H,9-10,12H2,1H3,(H,21,23)(H,22,24).
What are the key properties of N-(2-fluoro-5-methylphenyl)-6-oxo-3-phenylpiperidine-3-carboxamide?
N-(2-fluoro-5-methylphenyl)-6-oxo-3-phenylpiperidine-3-carboxamide has a molecular weight of 326.37 g/mol, XLogP of 2.92, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoro-5-methylphenyl)-6-oxo-3-phenylpiperidine-3-carboxamide is sourced from PubChem (CID 122134413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).