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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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).