N-cyclohexyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)benzenesulfonamide

C18H26N2O3S — CID 1072978

IUPACN-cyclohexyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)benzenesulfonamide
SMILESO=C(CN(C1CCCCC1)S(=O)(=O)c1ccccc1)N1CCCC1
InChIInChI=1S/C18H26N2O3S/c21-18(19-13-7-8-14-19)15-20(16-9-3-1-4-10-16)24(22,23)17-11-5-2-6-12-17/h2,5-6,11-12,16H,1,3-4,7-10,13-15H2
InChIKeySMUSUZMGPCNDFN-UHFFFAOYSA-N
MW350.48 g/mol
LogP2.63
Rot. Bonds5

About N-cyclohexyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)benzenesulfonamide

N-cyclohexyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)benzenesulfonamide (PubChem CID 1072978) has the molecular formula C18H26N2O3S and a molecular weight of 350.48 g/mol. Its IUPAC name is N-cyclohexyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)benzenesulfonamide.

Molecular Properties

Compound NameN-cyclohexyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)benzenesulfonamide
PubChem CID1072978
Molecular FormulaC18H26N2O3S
Molecular Weight350.48 g/mol
Exact Mass350.17
IUPAC NameN-cyclohexyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)benzenesulfonamide
SMILESO=C(CN(C1CCCCC1)S(=O)(=O)c1ccccc1)N1CCCC1
InChIInChI=1S/C18H26N2O3S/c21-18(19-13-7-8-14-19)15-20(16-9-3-1-4-10-16)24(22,23)17-11-5-2-6-12-17/h2,5-6,11-12,16H,1,3-4,7-10,13-15H2
InChIKeySMUSUZMGPCNDFN-UHFFFAOYSA-N
XLogP2.63
TPSA57.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.48
LogP ≤ 52.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(Phenylsulfonyl)amino]-1-pyrrolidinylethan-1-one
CID 891761
4-fluoro-N-[2-oxo-2-(1-pyrrolidinyl)ethyl]benzenesulfonamide
CID 900413
1-[N-(phenylsulfonyl)glycylglycyl]piperidine
CID 2233338
N-Ethyl-4-fluoro-N-(2-oxo-2-pyrrolidin-1-yl-ethyl)-benzenesulfonamide
CID 2985941
N-ethyl-N-[2-oxo-2-(piperidin-1-yl)ethyl]benzenesulfonamide
CID 2991053
N-Ethyl-N-(2-oxo-2-pyrrolidin-1-yl-ethyl)-benzenesulfonamide
CID 2985919
2-[cyclohexyl-(4-fluorophenyl)sulfonylamino]-N-methylacetamide
CID 799512
1,4-Bis(phenylsulfonyl)-2-piperazinone
CID 1214431
N-[2-(azepan-1-yl)-2-oxoethyl]-N-methylbenzenesulfonamide
CID 2188534
N-cycloheptyl-N~2~-ethyl-N~2~-(phenylsulfonyl)glycinamide
CID 2232318
Cambridge id 6458207
CID 2284358
2-[benzenesulfonyl(cyclohexyl)amino]-N-(2-methylpropyl)acetamide
CID 2292177

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)benzenesulfonamide?
The IUPAC name of N-cyclohexyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)benzenesulfonamide (CID 1072978) is N-cyclohexyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)benzenesulfonamide.
What is the SMILES notation for N-cyclohexyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)benzenesulfonamide?
The canonical SMILES for N-cyclohexyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)benzenesulfonamide is O=C(CN(C1CCCCC1)S(=O)(=O)c1ccccc1)N1CCCC1.
What is the InChIKey of N-cyclohexyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)benzenesulfonamide?
The InChIKey is SMUSUZMGPCNDFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O3S/c21-18(19-13-7-8-14-19)15-20(16-9-3-1-4-10-16)24(22,23)17-11-5-2-6-12-17/h2,5-6,11-12,16H,1,3-4,7-10,13-15H2.
What are the key properties of N-cyclohexyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)benzenesulfonamide?
N-cyclohexyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)benzenesulfonamide has a molecular weight of 350.48 g/mol, XLogP of 2.63, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)benzenesulfonamide is sourced from PubChem (CID 1072978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).