5-methyl-1-(2-oxo-1,2-diphenylethyl)piperidin-2-one

C20H21NO2 — CID 19049071

IUPAC5-methyl-1-(2-oxo-1,2-diphenylethyl)piperidin-2-one
SMILESCC1CCC(=O)N(C(C(=O)c2ccccc2)c2ccccc2)C1
InChIInChI=1S/C20H21NO2/c1-15-12-13-18(22)21(14-15)19(16-8-4-2-5-9-16)20(23)17-10-6-3-7-11-17/h2-11,15,19H,12-14H2,1H3
InChIKeyLHIKORJDKRXDDC-UHFFFAOYSA-N
MW307.39 g/mol
LogP3.87
Rot. Bonds4

About 5-methyl-1-(2-oxo-1,2-diphenylethyl)piperidin-2-one

5-methyl-1-(2-oxo-1,2-diphenylethyl)piperidin-2-one (PubChem CID 19049071) has the molecular formula C20H21NO2 and a molecular weight of 307.39 g/mol. Its IUPAC name is 5-methyl-1-(2-oxo-1,2-diphenylethyl)piperidin-2-one.

Molecular Properties

Compound Name5-methyl-1-(2-oxo-1,2-diphenylethyl)piperidin-2-one
PubChem CID19049071
Molecular FormulaC20H21NO2
Molecular Weight307.39 g/mol
Exact Mass307.16
IUPAC Name5-methyl-1-(2-oxo-1,2-diphenylethyl)piperidin-2-one
SMILESCC1CCC(=O)N(C(C(=O)c2ccccc2)c2ccccc2)C1
InChIInChI=1S/C20H21NO2/c1-15-12-13-18(22)21(14-15)19(16-8-4-2-5-9-16)20(23)17-10-6-3-7-11-17/h2-11,15,19H,12-14H2,1H3
InChIKeyLHIKORJDKRXDDC-UHFFFAOYSA-N
XLogP3.87
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.39
LogP ≤ 53.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(5S)-1-(2-hydroxy-1-phenylethyl)-5-methylpiperidin-2-one
CID 175215749
2-(2,3-dihydroindol-1-yl)-1,2-diphenylethanone
CID 139234692
2-(2-oxoazetidin-1-yl)-2-phenylacetic acid
CID 156875681
4-methyl-1-[(1S)-1-phenylethyl]piperidin-2-one
CID 53382448
1-(2-oxo-1,2-diphenylethyl)pyridin-2-one
CID 3828854
1-[2-(3-methoxypiperidin-1-yl)-2-oxo-1-phenylethyl]piperidin-2-one
CID 75420204
2-(4-methylpiperidin-1-yl)-2-phenylacetic acid chloride
CID 53350421
2-(1-oxo-1-phenylpropan-2-yl)-1,3,4,7,8,8a-hexahydropyrrolo[1,2-a]pyrazin-6-one
CID 82864087
N-[[4-[(3-methylpiperidin-1-yl)methyl]phenyl]methyl]-2-(2-oxopiperidin-1-yl)-2-phenylacetamide
CID 56505171
2-(3,5-dimethylpiperidin-1-yl)-1-phenylpropan-1-one
CID 43227828
(2R)-2-(4-methoxycarbonyl-2-oxopyrrolidin-1-yl)-2-phenylacetic acid
CID 168692814
(2R)-2-(4-carbamoyl-2-oxopyrrolidin-1-yl)-2-phenylacetic acid
CID 168695895

Frequently Asked Questions

What is the IUPAC name of 5-methyl-1-(2-oxo-1,2-diphenylethyl)piperidin-2-one?
The IUPAC name of 5-methyl-1-(2-oxo-1,2-diphenylethyl)piperidin-2-one (CID 19049071) is 5-methyl-1-(2-oxo-1,2-diphenylethyl)piperidin-2-one.
What is the SMILES notation for 5-methyl-1-(2-oxo-1,2-diphenylethyl)piperidin-2-one?
The canonical SMILES for 5-methyl-1-(2-oxo-1,2-diphenylethyl)piperidin-2-one is CC1CCC(=O)N(C(C(=O)c2ccccc2)c2ccccc2)C1.
What is the InChIKey of 5-methyl-1-(2-oxo-1,2-diphenylethyl)piperidin-2-one?
The InChIKey is LHIKORJDKRXDDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21NO2/c1-15-12-13-18(22)21(14-15)19(16-8-4-2-5-9-16)20(23)17-10-6-3-7-11-17/h2-11,15,19H,12-14H2,1H3.
What are the key properties of 5-methyl-1-(2-oxo-1,2-diphenylethyl)piperidin-2-one?
5-methyl-1-(2-oxo-1,2-diphenylethyl)piperidin-2-one has a molecular weight of 307.39 g/mol, XLogP of 3.87, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-1-(2-oxo-1,2-diphenylethyl)piperidin-2-one is sourced from PubChem (CID 19049071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).