N-methyl-1-(2-oxo-3-phenylpropyl)piperidine-2-carboxamide

C16H22N2O2 — CID 62036084

IUPACN-methyl-1-(2-oxo-3-phenylpropyl)piperidine-2-carboxamide
SMILESCNC(=O)C1CCCCN1CC(=O)Cc1ccccc1
InChIInChI=1S/C16H22N2O2/c1-17-16(20)15-9-5-6-10-18(15)12-14(19)11-13-7-3-2-4-8-13/h2-4,7-8,15H,5-6,9-12H2,1H3,(H,17,20)
InChIKeyMDCWCBHWKMARKR-UHFFFAOYSA-N
MW274.36 g/mol
LogP1.40
Rot. Bonds5

About N-methyl-1-(2-oxo-3-phenylpropyl)piperidine-2-carboxamide

N-methyl-1-(2-oxo-3-phenylpropyl)piperidine-2-carboxamide (PubChem CID 62036084) has the molecular formula C16H22N2O2 and a molecular weight of 274.36 g/mol. Its IUPAC name is N-methyl-1-(2-oxo-3-phenylpropyl)piperidine-2-carboxamide.

Molecular Properties

Compound NameN-methyl-1-(2-oxo-3-phenylpropyl)piperidine-2-carboxamide
PubChem CID62036084
Molecular FormulaC16H22N2O2
Molecular Weight274.36 g/mol
Exact Mass274.17
IUPAC NameN-methyl-1-(2-oxo-3-phenylpropyl)piperidine-2-carboxamide
SMILESCNC(=O)C1CCCCN1CC(=O)Cc1ccccc1
InChIInChI=1S/C16H22N2O2/c1-17-16(20)15-9-5-6-10-18(15)12-14(19)11-13-7-3-2-4-8-13/h2-4,7-8,15H,5-6,9-12H2,1H3,(H,17,20)
InChIKeyMDCWCBHWKMARKR-UHFFFAOYSA-N
XLogP1.40
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.36
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-methylpiperidin-1-yl)-3-phenylpropan-2-one
CID 43794410
1-[(2-hydroxyphenyl)methyl]-N-methylpiperidine-2-carboxamide
CID 82978861
1-(2-ethylazepan-1-yl)-3-phenylpropan-2-one
CID 113441826
(2S)-1-[2-[benzyl(cyclopropyl)amino]-2-oxoethyl]-N-methylpyrrolidine-2-carboxamide
CID 95289187
1-[2-(1,2-diphenylethylamino)-2-oxoethyl]-N-methylpyrrolidine-2-carboxamide
CID 60570248
1-(2-cyclohexyl-2-oxoethyl)-N-methylpyrrolidine-2-carboxamide
CID 104750574
1-[2-(4-fluorophenyl)-2-oxoethyl]-N-methylpiperidine-2-carboxamide
CID 62035887
1-[2-(hydroxymethyl)pyrrolidin-1-yl]-3-phenylpropan-2-one
CID 55038005
1-[(3-fluoro-2-hydroxyphenyl)methyl]-N-methylpiperidine-2-carboxamide
CID 112616195
1-[(3-amino-2-methylphenyl)methyl]-N-methylpiperidine-2-carboxamide
CID 54985708
1-[(2S)-2-amino-3-phenylpropanoyl]-N-methylpiperidine-2-carboxamide
CID 61163933
N-methyl-1-[(3-methylquinoxalin-2-yl)methyl]piperidine-2-carboxamide
CID 74236742

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(2-oxo-3-phenylpropyl)piperidine-2-carboxamide?
The IUPAC name of N-methyl-1-(2-oxo-3-phenylpropyl)piperidine-2-carboxamide (CID 62036084) is N-methyl-1-(2-oxo-3-phenylpropyl)piperidine-2-carboxamide.
What is the SMILES notation for N-methyl-1-(2-oxo-3-phenylpropyl)piperidine-2-carboxamide?
The canonical SMILES for N-methyl-1-(2-oxo-3-phenylpropyl)piperidine-2-carboxamide is CNC(=O)C1CCCCN1CC(=O)Cc1ccccc1.
What is the InChIKey of N-methyl-1-(2-oxo-3-phenylpropyl)piperidine-2-carboxamide?
The InChIKey is MDCWCBHWKMARKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O2/c1-17-16(20)15-9-5-6-10-18(15)12-14(19)11-13-7-3-2-4-8-13/h2-4,7-8,15H,5-6,9-12H2,1H3,(H,17,20).
What are the key properties of N-methyl-1-(2-oxo-3-phenylpropyl)piperidine-2-carboxamide?
N-methyl-1-(2-oxo-3-phenylpropyl)piperidine-2-carboxamide has a molecular weight of 274.36 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 N-methyl-1-(2-oxo-3-phenylpropyl)piperidine-2-carboxamide is sourced from PubChem (CID 62036084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).