N-(2-oxo-2-piperidin-1-ylethyl)-N-(2-phenylethyl)methanesulfonamide

C16H24N2O3S — CID 955961

IUPACN-(2-oxo-2-piperidin-1-ylethyl)-N-(2-phenylethyl)methanesulfonamide
SMILESCS(=O)(=O)N(CCc1ccccc1)CC(=O)N1CCCCC1
InChIInChI=1S/C16H24N2O3S/c1-22(20,21)18(13-10-15-8-4-2-5-9-15)14-16(19)17-11-6-3-7-12-17/h2,4-5,8-9H,3,6-7,10-14H2,1H3
InChIKeyWMMAEQUTRKMDNW-UHFFFAOYSA-N
MW324.45 g/mol
LogP1.50
Rot. Bonds6

About N-(2-oxo-2-piperidin-1-ylethyl)-N-(2-phenylethyl)methanesulfonamide

N-(2-oxo-2-piperidin-1-ylethyl)-N-(2-phenylethyl)methanesulfonamide (PubChem CID 955961) has the molecular formula C16H24N2O3S and a molecular weight of 324.45 g/mol. Its IUPAC name is N-(2-oxo-2-piperidin-1-ylethyl)-N-(2-phenylethyl)methanesulfonamide.

Molecular Properties

Compound NameN-(2-oxo-2-piperidin-1-ylethyl)-N-(2-phenylethyl)methanesulfonamide
PubChem CID955961
Molecular FormulaC16H24N2O3S
Molecular Weight324.45 g/mol
Exact Mass324.15
IUPAC NameN-(2-oxo-2-piperidin-1-ylethyl)-N-(2-phenylethyl)methanesulfonamide
SMILESCS(=O)(=O)N(CCc1ccccc1)CC(=O)N1CCCCC1
InChIInChI=1S/C16H24N2O3S/c1-22(20,21)18(13-10-15-8-4-2-5-9-15)14-16(19)17-11-6-3-7-12-17/h2,4-5,8-9H,3,6-7,10-14H2,1H3
InChIKeyWMMAEQUTRKMDNW-UHFFFAOYSA-N
XLogP1.50
TPSA57.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.45
LogP ≤ 51.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-oxo-2-piperidin-1-ylethyl)-N-(2-phenylethyl)methanesulfonamide?
The IUPAC name of N-(2-oxo-2-piperidin-1-ylethyl)-N-(2-phenylethyl)methanesulfonamide (CID 955961) is N-(2-oxo-2-piperidin-1-ylethyl)-N-(2-phenylethyl)methanesulfonamide.
What is the SMILES notation for N-(2-oxo-2-piperidin-1-ylethyl)-N-(2-phenylethyl)methanesulfonamide?
The canonical SMILES for N-(2-oxo-2-piperidin-1-ylethyl)-N-(2-phenylethyl)methanesulfonamide is CS(=O)(=O)N(CCc1ccccc1)CC(=O)N1CCCCC1.
What is the InChIKey of N-(2-oxo-2-piperidin-1-ylethyl)-N-(2-phenylethyl)methanesulfonamide?
The InChIKey is WMMAEQUTRKMDNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3S/c1-22(20,21)18(13-10-15-8-4-2-5-9-15)14-16(19)17-11-6-3-7-12-17/h2,4-5,8-9H,3,6-7,10-14H2,1H3.
What are the key properties of N-(2-oxo-2-piperidin-1-ylethyl)-N-(2-phenylethyl)methanesulfonamide?
N-(2-oxo-2-piperidin-1-ylethyl)-N-(2-phenylethyl)methanesulfonamide has a molecular weight of 324.45 g/mol, XLogP of 1.50, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-oxo-2-piperidin-1-ylethyl)-N-(2-phenylethyl)methanesulfonamide is sourced from PubChem (CID 955961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).