N-cyclopentylmethanesulfonamide

C6H13NO2S — CID 799038

IUPACN-cyclopentylmethanesulfonamide
SMILESCS(=O)(=O)NC1CCCC1
InChIInChI=1S/C6H13NO2S/c1-10(8,9)7-6-4-2-3-5-6/h6-7H,2-5H2,1H3
InChIKeyIJXUJLYIQLLJEP-UHFFFAOYSA-N
MW163.24 g/mol
LogP0.48
Rot. Bonds2

About N-cyclopentylmethanesulfonamide

N-cyclopentylmethanesulfonamide (PubChem CID 799038) has the molecular formula C6H13NO2S and a molecular weight of 163.24 g/mol. Its IUPAC name is N-cyclopentylmethanesulfonamide.

Molecular Properties

Compound NameN-cyclopentylmethanesulfonamide
PubChem CID799038
Molecular FormulaC6H13NO2S
Molecular Weight163.24 g/mol
Exact Mass163.07
IUPAC NameN-cyclopentylmethanesulfonamide
SMILESCS(=O)(=O)NC1CCCC1
InChIInChI=1S/C6H13NO2S/c1-10(8,9)7-6-4-2-3-5-6/h6-7H,2-5H2,1H3
InChIKeyIJXUJLYIQLLJEP-UHFFFAOYSA-N
XLogP0.48
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.24
LogP ≤ 50.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentylmethanesulfonamide?
The IUPAC name of N-cyclopentylmethanesulfonamide (CID 799038) is N-cyclopentylmethanesulfonamide.
What is the SMILES notation for N-cyclopentylmethanesulfonamide?
The canonical SMILES for N-cyclopentylmethanesulfonamide is CS(=O)(=O)NC1CCCC1.
What is the InChIKey of N-cyclopentylmethanesulfonamide?
The InChIKey is IJXUJLYIQLLJEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO2S/c1-10(8,9)7-6-4-2-3-5-6/h6-7H,2-5H2,1H3.
What are the key properties of N-cyclopentylmethanesulfonamide?
N-cyclopentylmethanesulfonamide has a molecular weight of 163.24 g/mol, XLogP of 0.48, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentylmethanesulfonamide is sourced from PubChem (CID 799038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).