2-methyl-N-(1-methyl-2-phenylcyclopent-2-en-1-yl)propane-2-sulfonamide

C16H23NO2S — CID 102388634

IUPAC2-methyl-N-(1-methyl-2-phenylcyclopent-2-en-1-yl)propane-2-sulfonamide
SMILESCC1(NS(=O)(=O)C(C)(C)C)CCC=C1c1ccccc1
InChIInChI=1S/C16H23NO2S/c1-15(2,3)20(18,19)17-16(4)12-8-11-14(16)13-9-6-5-7-10-13/h5-7,9-11,17H,8,12H2,1-4H3
InChIKeyYVSVYKWJMXFYGR-UHFFFAOYSA-N
MW293.43 g/mol
LogP3.34
Rot. Bonds3

About 2-methyl-N-(1-methyl-2-phenylcyclopent-2-en-1-yl)propane-2-sulfonamide

2-methyl-N-(1-methyl-2-phenylcyclopent-2-en-1-yl)propane-2-sulfonamide (PubChem CID 102388634) has the molecular formula C16H23NO2S and a molecular weight of 293.43 g/mol. Its IUPAC name is 2-methyl-N-(1-methyl-2-phenylcyclopent-2-en-1-yl)propane-2-sulfonamide.

Molecular Properties

Compound Name2-methyl-N-(1-methyl-2-phenylcyclopent-2-en-1-yl)propane-2-sulfonamide
PubChem CID102388634
Molecular FormulaC16H23NO2S
Molecular Weight293.43 g/mol
Exact Mass293.14
IUPAC Name2-methyl-N-(1-methyl-2-phenylcyclopent-2-en-1-yl)propane-2-sulfonamide
SMILESCC1(NS(=O)(=O)C(C)(C)C)CCC=C1c1ccccc1
InChIInChI=1S/C16H23NO2S/c1-15(2,3)20(18,19)17-16(4)12-8-11-14(16)13-9-6-5-7-10-13/h5-7,9-11,17H,8,12H2,1-4H3
InChIKeyYVSVYKWJMXFYGR-UHFFFAOYSA-N
XLogP3.34
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.43
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-phenylbutyl)ethanesulfonamide
CID 2179616
N-(3-phenylpropyl)ethanesulfonamide
CID 2167095
(+/-) Propane-2-sulfonic acid (2-phenyl-cyclopentyl)-amide
CID 10199241
N-(6-methylheptan-2-yl)-1-phenylmethanesulfonamide
CID 2915412
cis-[(Methylethyl)sulfonyl](2-phenylcyclopentyl)amine
CID 11119059
1-phenyl-N-(2,4,4-trimethylpentan-2-yl)methanesulfonamide
CID 2963215
(+,-) Trans-propane-2-sulfonic Acid (2-phenyl-cyclopentyl)-amide
CID 10956500
N-[(1S,2S)-2-phenylcyclopentyl]propane-2-sulfonamide
CID 11747568
(R)-N-(2-phenylpropyl)propane-2-sulfonamide
CID 21893415
N-(1-phenylethyl)ethanesulfonamide
CID 2932389
Benzenesulfonamide, 4-methyl-N-(1-(phenylmethyl)cyclopentyl)-
CID 218221
N-[(E,1R)-1-phenyl-2-propylhex-2-enyl]methanesulfonamide
CID 44592829

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(1-methyl-2-phenylcyclopent-2-en-1-yl)propane-2-sulfonamide?
The IUPAC name of 2-methyl-N-(1-methyl-2-phenylcyclopent-2-en-1-yl)propane-2-sulfonamide (CID 102388634) is 2-methyl-N-(1-methyl-2-phenylcyclopent-2-en-1-yl)propane-2-sulfonamide.
What is the SMILES notation for 2-methyl-N-(1-methyl-2-phenylcyclopent-2-en-1-yl)propane-2-sulfonamide?
The canonical SMILES for 2-methyl-N-(1-methyl-2-phenylcyclopent-2-en-1-yl)propane-2-sulfonamide is CC1(NS(=O)(=O)C(C)(C)C)CCC=C1c1ccccc1.
What is the InChIKey of 2-methyl-N-(1-methyl-2-phenylcyclopent-2-en-1-yl)propane-2-sulfonamide?
The InChIKey is YVSVYKWJMXFYGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23NO2S/c1-15(2,3)20(18,19)17-16(4)12-8-11-14(16)13-9-6-5-7-10-13/h5-7,9-11,17H,8,12H2,1-4H3.
What are the key properties of 2-methyl-N-(1-methyl-2-phenylcyclopent-2-en-1-yl)propane-2-sulfonamide?
2-methyl-N-(1-methyl-2-phenylcyclopent-2-en-1-yl)propane-2-sulfonamide has a molecular weight of 293.43 g/mol, XLogP of 3.34, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(1-methyl-2-phenylcyclopent-2-en-1-yl)propane-2-sulfonamide is sourced from PubChem (CID 102388634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).