2-methyl-N-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]benzenesulfonamide

C19H22N2O3S — CID 110286822

IUPAC2-methyl-N-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]benzenesulfonamide
SMILESCc1ccccc1S(=O)(=O)N[C@H](C(=O)N1CCCC1)c1ccccc1
InChIInChI=1S/C19H22N2O3S/c1-15-9-5-6-12-17(15)25(23,24)20-18(16-10-3-2-4-11-16)19(22)21-13-7-8-14-21/h2-6,9-12,18,20H,7-8,13-14H2,1H3/t18-/m0/s1
InChIKeyQQYUAXQELLIOGG-SFHVURJKSA-N
MW358.46 g/mol
LogP2.64
Rot. Bonds5

About 2-methyl-N-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]benzenesulfonamide

2-methyl-N-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]benzenesulfonamide (PubChem CID 110286822) has the molecular formula C19H22N2O3S and a molecular weight of 358.46 g/mol. Its IUPAC name is 2-methyl-N-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]benzenesulfonamide.

Molecular Properties

Compound Name2-methyl-N-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]benzenesulfonamide
PubChem CID110286822
Molecular FormulaC19H22N2O3S
Molecular Weight358.46 g/mol
Exact Mass358.14
IUPAC Name2-methyl-N-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]benzenesulfonamide
SMILESCc1ccccc1S(=O)(=O)N[C@H](C(=O)N1CCCC1)c1ccccc1
InChIInChI=1S/C19H22N2O3S/c1-15-9-5-6-12-17(15)25(23,24)20-18(16-10-3-2-4-11-16)19(22)21-13-7-8-14-21/h2-6,9-12,18,20H,7-8,13-14H2,1H3/t18-/m0/s1
InChIKeyQQYUAXQELLIOGG-SFHVURJKSA-N
XLogP2.64
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.46
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-methylphenyl)-N-[(1S)-2-oxo-1-phenyl-2-piperidin-1-ylethyl]methanesulfonamide
CID 110286886
5-ethyl-N-[(1S)-2-oxo-1-phenyl-2-piperidin-1-ylethyl]thiophene-2-sulfonamide
CID 110286882
2-methyl-N-[(1S)-2-oxo-1-phenyl-2-piperidin-1-ylethyl]benzamide
CID 110286837
2,2-dimethyl-N-[(1S)-2-oxo-1-phenyl-2-piperidin-1-ylethyl]propanamide
CID 110286834
N-[4-[[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]amino]phenyl]methanesulfonamide
CID 31268510
3-methyl-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]benzenesulfonamide
CID 110286976
(3R)-3-[(2-methylphenyl)sulfonylamino]-3-phenylpropanoic acid
CID 726567
(2S)-2-[(2-chlorophenyl)sulfonylamino]-2-phenyl-N-propan-2-ylacetamide
CID 110286720
N-[2-[(2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl)amino]ethyl]ethanesulfonamide
CID 51107460
(2S)-2-[(2,5-dimethylphenyl)sulfonylamino]-2-phenyl-N-propan-2-ylacetamide
CID 110286675
2-fluoro-N-[(2S)-3-methyl-1-oxo-1-pyrrolidin-1-ylbutan-2-yl]benzenesulfonamide
CID 18108558
2-methyl-N-(3-oxo-3-piperidin-1-ylpropyl)benzenesulfonamide
CID 115671903

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]benzenesulfonamide?
The IUPAC name of 2-methyl-N-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]benzenesulfonamide (CID 110286822) is 2-methyl-N-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]benzenesulfonamide.
What is the SMILES notation for 2-methyl-N-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]benzenesulfonamide?
The canonical SMILES for 2-methyl-N-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]benzenesulfonamide is Cc1ccccc1S(=O)(=O)N[C@H](C(=O)N1CCCC1)c1ccccc1.
What is the InChIKey of 2-methyl-N-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]benzenesulfonamide?
The InChIKey is QQYUAXQELLIOGG-SFHVURJKSA-N. The full InChI is InChI=1S/C19H22N2O3S/c1-15-9-5-6-12-17(15)25(23,24)20-18(16-10-3-2-4-11-16)19(22)21-13-7-8-14-21/h2-6,9-12,18,20H,7-8,13-14H2,1H3/t18-/m0/s1.
What are the key properties of 2-methyl-N-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]benzenesulfonamide?
2-methyl-N-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]benzenesulfonamide has a molecular weight of 358.46 g/mol, XLogP of 2.64, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]benzenesulfonamide is sourced from PubChem (CID 110286822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).