N-(cyclopentylmethyl)-N-methylmethanesulfonamide

C8H17NO2S — CID 62069472

IUPACN-(cyclopentylmethyl)-N-methylmethanesulfonamide
SMILESCN(CC1CCCC1)S(C)(=O)=O
InChIInChI=1S/C8H17NO2S/c1-9(12(2,10)11)7-8-5-3-4-6-8/h8H,3-7H2,1-2H3
InChIKeyNKGMVMKXFGTXMS-UHFFFAOYSA-N
MW191.30 g/mol
LogP1.07
Rot. Bonds3

About N-(cyclopentylmethyl)-N-methylmethanesulfonamide

N-(cyclopentylmethyl)-N-methylmethanesulfonamide (PubChem CID 62069472) has the molecular formula C8H17NO2S and a molecular weight of 191.30 g/mol. Its IUPAC name is N-(cyclopentylmethyl)-N-methylmethanesulfonamide.

Molecular Properties

Compound NameN-(cyclopentylmethyl)-N-methylmethanesulfonamide
PubChem CID62069472
Molecular FormulaC8H17NO2S
Molecular Weight191.30 g/mol
Exact Mass191.10
IUPAC NameN-(cyclopentylmethyl)-N-methylmethanesulfonamide
SMILESCN(CC1CCCC1)S(C)(=O)=O
InChIInChI=1S/C8H17NO2S/c1-9(12(2,10)11)7-8-5-3-4-6-8/h8H,3-7H2,1-2H3
InChIKeyNKGMVMKXFGTXMS-UHFFFAOYSA-N
XLogP1.07
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.30
LogP ≤ 51.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(cyclopentylmethyl)-N-methylmethanesulfonamide?
The IUPAC name of N-(cyclopentylmethyl)-N-methylmethanesulfonamide (CID 62069472) is N-(cyclopentylmethyl)-N-methylmethanesulfonamide.
What is the SMILES notation for N-(cyclopentylmethyl)-N-methylmethanesulfonamide?
The canonical SMILES for N-(cyclopentylmethyl)-N-methylmethanesulfonamide is CN(CC1CCCC1)S(C)(=O)=O.
What is the InChIKey of N-(cyclopentylmethyl)-N-methylmethanesulfonamide?
The InChIKey is NKGMVMKXFGTXMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO2S/c1-9(12(2,10)11)7-8-5-3-4-6-8/h8H,3-7H2,1-2H3.
What are the key properties of N-(cyclopentylmethyl)-N-methylmethanesulfonamide?
N-(cyclopentylmethyl)-N-methylmethanesulfonamide has a molecular weight of 191.30 g/mol, XLogP of 1.07, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopentylmethyl)-N-methylmethanesulfonamide is sourced from PubChem (CID 62069472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).