N-[(1-cyclopentyl-5-oxopyrrolidin-3-yl)methyl]-3-methoxy-N-methylbenzenesulfonamide

C18H26N2O4S — CID 131890870

IUPACN-[(1-cyclopentyl-5-oxopyrrolidin-3-yl)methyl]-3-methoxy-N-methylbenzenesulfonamide
SMILESCOc1cccc(S(=O)(=O)N(C)CC2CC(=O)N(C3CCCC3)C2)c1
InChIInChI=1S/C18H26N2O4S/c1-19(25(22,23)17-9-5-8-16(11-17)24-2)12-14-10-18(21)20(13-14)15-6-3-4-7-15/h5,8-9,11,14-15H,3-4,6-7,10,12-13H2,1-2H3
InChIKeyVJRSFOQEHRJIMZ-UHFFFAOYSA-N
MW366.48 g/mol
LogP2.11
Rot. Bonds6

About N-[(1-cyclopentyl-5-oxopyrrolidin-3-yl)methyl]-3-methoxy-N-methylbenzenesulfonamide

N-[(1-cyclopentyl-5-oxopyrrolidin-3-yl)methyl]-3-methoxy-N-methylbenzenesulfonamide (PubChem CID 131890870) has the molecular formula C18H26N2O4S and a molecular weight of 366.48 g/mol. Its IUPAC name is N-[(1-cyclopentyl-5-oxopyrrolidin-3-yl)methyl]-3-methoxy-N-methylbenzenesulfonamide.

Molecular Properties

Compound NameN-[(1-cyclopentyl-5-oxopyrrolidin-3-yl)methyl]-3-methoxy-N-methylbenzenesulfonamide
PubChem CID131890870
Molecular FormulaC18H26N2O4S
Molecular Weight366.48 g/mol
Exact Mass366.16
IUPAC NameN-[(1-cyclopentyl-5-oxopyrrolidin-3-yl)methyl]-3-methoxy-N-methylbenzenesulfonamide
SMILESCOc1cccc(S(=O)(=O)N(C)CC2CC(=O)N(C3CCCC3)C2)c1
InChIInChI=1S/C18H26N2O4S/c1-19(25(22,23)17-9-5-8-16(11-17)24-2)12-14-10-18(21)20(13-14)15-6-3-4-7-15/h5,8-9,11,14-15H,3-4,6-7,10,12-13H2,1-2H3
InChIKeyVJRSFOQEHRJIMZ-UHFFFAOYSA-N
XLogP2.11
TPSA66.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.48
LogP ≤ 52.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-[(1-cyclopentyl-5-oxopyrrolidin-3-yl)methyl]-3-methoxy-N-methylbenzenesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(1-cyclopentyl-5-oxopyrrolidin-3-yl)methyl]-4-fluoro-N-methylbenzenesulfonamide
CID 131926041
1-[[(3S)-1-cyclopentyl-5-oxopyrrolidin-3-yl]methyl]-3-[(3-methoxyphenyl)methyl]-1-methylurea
CID 126448423
2-chloro-N-[(1-cyclopentyl-5-oxopyrrolidin-3-yl)methyl]-4-fluoro-N,5-dimethylbenzenesulfonamide
CID 131924432
N-methyl-N-[(1-methyl-5-oxopyrrolidin-3-yl)methyl]benzenesulfonamide
CID 131899676
(4S)-1-cyclopentyl-4-[[(4,6-dimethylpyrimidin-2-yl)-methylamino]methyl]pyrrolidin-2-one
CID 95122565
N-(cyclohexylmethyl)-3-hydroxy-N-methylbenzenesulfonamide
CID 81259352
(3S)-1-cyclopentyl-N-[(3-methoxyphenyl)methyl]-5-oxopyrrolidine-3-carboxamide
CID 32734074
1-cyclohexyl-N-[(3-methoxyphenyl)methyl]-5-oxopyrrolidine-3-carboxamide
CID 4251315
N-[(1-cyclopentyl-5-oxopyrrolidin-3-yl)methyl]-4-methylsulfonylbenzenesulfonamide
CID 131935678
3-bromo-N-(cyclopropylmethyl)-N-methylbenzenesulfonamide
CID 60985680
3-bromo-N-(cyclopentylmethyl)-4-methoxy-N-methylbenzenesulfonamide
CID 47480383
3-chloro-N-[(1-cyclopropyl-5-oxopyrrolidin-3-yl)methyl]benzenesulfonamide
CID 110719965

Frequently Asked Questions

What is the IUPAC name of N-[(1-cyclopentyl-5-oxopyrrolidin-3-yl)methyl]-3-methoxy-N-methylbenzenesulfonamide?
The IUPAC name of N-[(1-cyclopentyl-5-oxopyrrolidin-3-yl)methyl]-3-methoxy-N-methylbenzenesulfonamide (CID 131890870) is N-[(1-cyclopentyl-5-oxopyrrolidin-3-yl)methyl]-3-methoxy-N-methylbenzenesulfonamide.
What is the SMILES notation for N-[(1-cyclopentyl-5-oxopyrrolidin-3-yl)methyl]-3-methoxy-N-methylbenzenesulfonamide?
The canonical SMILES for N-[(1-cyclopentyl-5-oxopyrrolidin-3-yl)methyl]-3-methoxy-N-methylbenzenesulfonamide is COc1cccc(S(=O)(=O)N(C)CC2CC(=O)N(C3CCCC3)C2)c1.
What is the InChIKey of N-[(1-cyclopentyl-5-oxopyrrolidin-3-yl)methyl]-3-methoxy-N-methylbenzenesulfonamide?
The InChIKey is VJRSFOQEHRJIMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O4S/c1-19(25(22,23)17-9-5-8-16(11-17)24-2)12-14-10-18(21)20(13-14)15-6-3-4-7-15/h5,8-9,11,14-15H,3-4,6-7,10,12-13H2,1-2H3.
What are the key properties of N-[(1-cyclopentyl-5-oxopyrrolidin-3-yl)methyl]-3-methoxy-N-methylbenzenesulfonamide?
N-[(1-cyclopentyl-5-oxopyrrolidin-3-yl)methyl]-3-methoxy-N-methylbenzenesulfonamide has a molecular weight of 366.48 g/mol, XLogP of 2.11, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-cyclopentyl-5-oxopyrrolidin-3-yl)methyl]-3-methoxy-N-methylbenzenesulfonamide is sourced from PubChem (CID 131890870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).