N-methyl-N-(2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl)methanesulfonamide

C14H20N2O3S — CID 133161882

IUPACN-methyl-N-(2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl)methanesulfonamide
SMILESCN(C(C(=O)N1CCCC1)c1ccccc1)S(C)(=O)=O
InChIInChI=1S/C14H20N2O3S/c1-15(20(2,18)19)13(12-8-4-3-5-9-12)14(17)16-10-6-7-11-16/h3-5,8-9,13H,6-7,10-11H2,1-2H3
InChIKeyQMHVQHMXQGANAP-UHFFFAOYSA-N
MW296.39 g/mol
LogP1.24
Rot. Bonds4

About N-methyl-N-(2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl)methanesulfonamide

N-methyl-N-(2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl)methanesulfonamide (PubChem CID 133161882) has the molecular formula C14H20N2O3S and a molecular weight of 296.39 g/mol. Its IUPAC name is N-methyl-N-(2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl)methanesulfonamide.

Molecular Properties

Compound NameN-methyl-N-(2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl)methanesulfonamide
PubChem CID133161882
Molecular FormulaC14H20N2O3S
Molecular Weight296.39 g/mol
Exact Mass296.12
IUPAC NameN-methyl-N-(2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl)methanesulfonamide
SMILESCN(C(C(=O)N1CCCC1)c1ccccc1)S(C)(=O)=O
InChIInChI=1S/C14H20N2O3S/c1-15(20(2,18)19)13(12-8-4-3-5-9-12)14(17)16-10-6-7-11-16/h3-5,8-9,13H,6-7,10-11H2,1-2H3
InChIKeyQMHVQHMXQGANAP-UHFFFAOYSA-N
XLogP1.24
TPSA57.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.39
LogP ≤ 51.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-N-[(1S)-2-(4-methylpiperazin-1-yl)-2-oxo-1-phenylethyl]methanesulfonamide
CID 125054281
N-methyl-N-[2-oxo-1-phenyl-2-(4-phenylpiperazin-1-yl)ethyl]methanesulfonamide
CID 133184784
N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-1-phenylethyl]-N-methylmethanesulfonamide
CID 133210680
N-methyl-N-[2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-oxo-1-phenylethyl]methanesulfonamide
CID 133187649
1-(azetidin-1-yl)-2-(dimethylamino)-2-phenylethanone
CID 143781078
N,N-dimethyl-2-[methyl(methylsulfonyl)amino]-2-phenylacetamide
CID 133219262
N-[(1S)-2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-oxo-1-phenylethyl]-N-methylmethanesulfonamide
CID 125054870
N-methyl-N-[1-(2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl)piperidin-4-yl]methanesulfonamide
CID 48736574
2-[methyl(methylsulfonyl)amino]-2-phenyl-N-(4-pyrrolidin-1-ylphenyl)acetamide
CID 133166793
N-methyl-2-[methyl(methylsulfonyl)amino]-2-phenylacetamide
CID 133224889
(2S)-2-[methyl(methylsulfonyl)amino]-2-phenyl-N-[[2-(piperidin-1-ylmethyl)phenyl]methyl]acetamide
CID 125072960
N-methyl-N-[(1S)-2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-2-oxo-1-phenylethyl]methanesulfonamide
CID 125057224

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl)methanesulfonamide?
The IUPAC name of N-methyl-N-(2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl)methanesulfonamide (CID 133161882) is N-methyl-N-(2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl)methanesulfonamide.
What is the SMILES notation for N-methyl-N-(2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl)methanesulfonamide?
The canonical SMILES for N-methyl-N-(2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl)methanesulfonamide is CN(C(C(=O)N1CCCC1)c1ccccc1)S(C)(=O)=O.
What is the InChIKey of N-methyl-N-(2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl)methanesulfonamide?
The InChIKey is QMHVQHMXQGANAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3S/c1-15(20(2,18)19)13(12-8-4-3-5-9-12)14(17)16-10-6-7-11-16/h3-5,8-9,13H,6-7,10-11H2,1-2H3.
What are the key properties of N-methyl-N-(2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl)methanesulfonamide?
N-methyl-N-(2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl)methanesulfonamide has a molecular weight of 296.39 g/mol, XLogP of 1.24, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl)methanesulfonamide is sourced from PubChem (CID 133161882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).