2-chloro-N-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]benzenesulfonamide

C16H15ClN2O3S — CID 95255094

IUPAC2-chloro-N-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]benzenesulfonamide
SMILESO=C1[C@H](NS(=O)(=O)c2ccccc2Cl)CCN1c1ccccc1
InChIInChI=1S/C16H15ClN2O3S/c17-13-8-4-5-9-15(13)23(21,22)18-14-10-11-19(16(14)20)12-6-2-1-3-7-12/h1-9,14,18H,10-11H2/t14-/m1/s1
InChIKeyYNBDYFGYYMCTON-CQSZACIVSA-N
MW350.83 g/mol
LogP2.42
Rot. Bonds4

About 2-chloro-N-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]benzenesulfonamide

2-chloro-N-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]benzenesulfonamide (PubChem CID 95255094) has the molecular formula C16H15ClN2O3S and a molecular weight of 350.83 g/mol. Its IUPAC name is 2-chloro-N-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]benzenesulfonamide.

Molecular Properties

Compound Name2-chloro-N-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]benzenesulfonamide
PubChem CID95255094
Molecular FormulaC16H15ClN2O3S
Molecular Weight350.83 g/mol
Exact Mass350.05
IUPAC Name2-chloro-N-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]benzenesulfonamide
SMILESO=C1[C@H](NS(=O)(=O)c2ccccc2Cl)CCN1c1ccccc1
InChIInChI=1S/C16H15ClN2O3S/c17-13-8-4-5-9-15(13)23(21,22)18-14-10-11-19(16(14)20)12-6-2-1-3-7-12/h1-9,14,18H,10-11H2/t14-/m1/s1
InChIKeyYNBDYFGYYMCTON-CQSZACIVSA-N
XLogP2.42
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.83
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-ethyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)benzenesulfonamide
CID 71838669
2-chloro-6-methyl-N-[(3S)-2-oxo-1-phenylpyrrolidin-3-yl]benzenesulfonamide
CID 95101432
2,5-difluoro-N-[(3S)-2-oxo-1-phenylpyrrolidin-3-yl]benzenesulfonamide
CID 95255063
2-fluoro-N-[1-(4-fluorophenyl)-2-oxopyrrolidin-3-yl]benzenesulfonamide
CID 71835736
3-bromo-N-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]benzenesulfonamide
CID 95101436
2-chloro-N-[1-(4-fluorophenyl)-2-oxopyrrolidin-3-yl]-6-methylbenzenesulfonamide
CID 71838586
2,3-difluoro-N-[1-(4-methylphenyl)-2-oxopyrrolidin-3-yl]benzenesulfonamide
CID 126796000
1-(2-chlorophenyl)-N-[1-(4-methoxyphenyl)-2-oxopyrrolidin-3-yl]methanesulfonamide
CID 53166772
3-(methylamino)-1-phenylazepan-2-one
CID 20589821
5-amino-2-chloro-N-(1-methyl-2-oxopyrrolidin-3-yl)benzenesulfonamide
CID 106250243
4-[(2-oxo-1-phenylpyrrolidin-3-yl)amino]benzenesulfonamide
CID 164619903
2-[4-[3-(benzenesulfonamido)-2-oxopiperidin-1-yl]phenyl]-N-tert-butylbenzenesulfonamide
CID 142196519

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]benzenesulfonamide?
The IUPAC name of 2-chloro-N-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]benzenesulfonamide (CID 95255094) is 2-chloro-N-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]benzenesulfonamide.
What is the SMILES notation for 2-chloro-N-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]benzenesulfonamide?
The canonical SMILES for 2-chloro-N-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]benzenesulfonamide is O=C1[C@H](NS(=O)(=O)c2ccccc2Cl)CCN1c1ccccc1.
What is the InChIKey of 2-chloro-N-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]benzenesulfonamide?
The InChIKey is YNBDYFGYYMCTON-CQSZACIVSA-N. The full InChI is InChI=1S/C16H15ClN2O3S/c17-13-8-4-5-9-15(13)23(21,22)18-14-10-11-19(16(14)20)12-6-2-1-3-7-12/h1-9,14,18H,10-11H2/t14-/m1/s1.
What are the key properties of 2-chloro-N-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]benzenesulfonamide?
2-chloro-N-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]benzenesulfonamide has a molecular weight of 350.83 g/mol, XLogP of 2.42, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[(3R)-2-oxo-1-phenylpyrrolidin-3-yl]benzenesulfonamide is sourced from PubChem (CID 95255094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).