N-(1-benzylcyclopentyl)methanesulfonamide

C13H19NO2S — CID 24840126

IUPACN-(1-benzylcyclopentyl)methanesulfonamide
SMILESCS(=O)(=O)NC1(Cc2ccccc2)CCCC1
InChIInChI=1S/C13H19NO2S/c1-17(15,16)14-13(9-5-6-10-13)11-12-7-3-2-4-8-12/h2-4,7-8,14H,5-6,9-11H2,1H3
InChIKeyAPBZFLXKRRJOBS-UHFFFAOYSA-N
MW253.37 g/mol
LogP2.09
Rot. Bonds4

About N-(1-benzylcyclopentyl)methanesulfonamide

N-(1-benzylcyclopentyl)methanesulfonamide (PubChem CID 24840126) has the molecular formula C13H19NO2S and a molecular weight of 253.37 g/mol. Its IUPAC name is N-(1-benzylcyclopentyl)methanesulfonamide.

Molecular Properties

Compound NameN-(1-benzylcyclopentyl)methanesulfonamide
PubChem CID24840126
Molecular FormulaC13H19NO2S
Molecular Weight253.37 g/mol
Exact Mass253.11
IUPAC NameN-(1-benzylcyclopentyl)methanesulfonamide
SMILESCS(=O)(=O)NC1(Cc2ccccc2)CCCC1
InChIInChI=1S/C13H19NO2S/c1-17(15,16)14-13(9-5-6-10-13)11-12-7-3-2-4-8-12/h2-4,7-8,14H,5-6,9-11H2,1H3
InChIKeyAPBZFLXKRRJOBS-UHFFFAOYSA-N
XLogP2.09
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.37
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(1-benzylcyclopentyl)methanesulfonamide?
The IUPAC name of N-(1-benzylcyclopentyl)methanesulfonamide (CID 24840126) is N-(1-benzylcyclopentyl)methanesulfonamide.
What is the SMILES notation for N-(1-benzylcyclopentyl)methanesulfonamide?
The canonical SMILES for N-(1-benzylcyclopentyl)methanesulfonamide is CS(=O)(=O)NC1(Cc2ccccc2)CCCC1.
What is the InChIKey of N-(1-benzylcyclopentyl)methanesulfonamide?
The InChIKey is APBZFLXKRRJOBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO2S/c1-17(15,16)14-13(9-5-6-10-13)11-12-7-3-2-4-8-12/h2-4,7-8,14H,5-6,9-11H2,1H3.
What are the key properties of N-(1-benzylcyclopentyl)methanesulfonamide?
N-(1-benzylcyclopentyl)methanesulfonamide has a molecular weight of 253.37 g/mol, XLogP of 2.09, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-benzylcyclopentyl)methanesulfonamide is sourced from PubChem (CID 24840126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).