N-[(1R,2R)-2-(4-methylphenyl)cyclopentyl]propane-2-sulfonamide

C15H23NO2S — CID 10967953

IUPACN-[(1R,2R)-2-(4-methylphenyl)cyclopentyl]propane-2-sulfonamide
SMILESCc1ccc([C@H]2CCC[C@H]2NS(=O)(=O)C(C)C)cc1
InChIInChI=1S/C15H23NO2S/c1-11(2)19(17,18)16-15-6-4-5-14(15)13-9-7-12(3)8-10-13/h7-11,14-16H,4-6H2,1-3H3/t14-,15-/m1/s1
InChIKeyBIEDOYNLBIISIW-HUUCEWRRSA-N
MW281.42 g/mol
LogP2.96
Rot. Bonds4

About N-[(1R,2R)-2-(4-methylphenyl)cyclopentyl]propane-2-sulfonamide

N-[(1R,2R)-2-(4-methylphenyl)cyclopentyl]propane-2-sulfonamide (PubChem CID 10967953) has the molecular formula C15H23NO2S and a molecular weight of 281.42 g/mol. Its IUPAC name is N-[(1R,2R)-2-(4-methylphenyl)cyclopentyl]propane-2-sulfonamide.

Molecular Properties

Compound NameN-[(1R,2R)-2-(4-methylphenyl)cyclopentyl]propane-2-sulfonamide
PubChem CID10967953
Molecular FormulaC15H23NO2S
Molecular Weight281.42 g/mol
Exact Mass281.14
IUPAC NameN-[(1R,2R)-2-(4-methylphenyl)cyclopentyl]propane-2-sulfonamide
SMILESCc1ccc([C@H]2CCC[C@H]2NS(=O)(=O)C(C)C)cc1
InChIInChI=1S/C15H23NO2S/c1-11(2)19(17,18)16-15-6-4-5-14(15)13-9-7-12(3)8-10-13/h7-11,14-16H,4-6H2,1-3H3/t14-,15-/m1/s1
InChIKeyBIEDOYNLBIISIW-HUUCEWRRSA-N
XLogP2.96
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.42
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[(1R,2R)-2-(4-methylphenyl)cyclopentyl]propane-2-sulfonamide?
The IUPAC name of N-[(1R,2R)-2-(4-methylphenyl)cyclopentyl]propane-2-sulfonamide (CID 10967953) is N-[(1R,2R)-2-(4-methylphenyl)cyclopentyl]propane-2-sulfonamide.
What is the SMILES notation for N-[(1R,2R)-2-(4-methylphenyl)cyclopentyl]propane-2-sulfonamide?
The canonical SMILES for N-[(1R,2R)-2-(4-methylphenyl)cyclopentyl]propane-2-sulfonamide is Cc1ccc([C@H]2CCC[C@H]2NS(=O)(=O)C(C)C)cc1.
What is the InChIKey of N-[(1R,2R)-2-(4-methylphenyl)cyclopentyl]propane-2-sulfonamide?
The InChIKey is BIEDOYNLBIISIW-HUUCEWRRSA-N. The full InChI is InChI=1S/C15H23NO2S/c1-11(2)19(17,18)16-15-6-4-5-14(15)13-9-7-12(3)8-10-13/h7-11,14-16H,4-6H2,1-3H3/t14-,15-/m1/s1.
What are the key properties of N-[(1R,2R)-2-(4-methylphenyl)cyclopentyl]propane-2-sulfonamide?
N-[(1R,2R)-2-(4-methylphenyl)cyclopentyl]propane-2-sulfonamide has a molecular weight of 281.42 g/mol, XLogP of 2.96, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R,2R)-2-(4-methylphenyl)cyclopentyl]propane-2-sulfonamide is sourced from PubChem (CID 10967953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).