N-(cyclopentylmethyl)-N-methylpropane-1-sulfonamide

C10H21NO2S — CID 62068860

IUPACN-(cyclopentylmethyl)-N-methylpropane-1-sulfonamide
SMILESCCCS(=O)(=O)N(C)CC1CCCC1
InChIInChI=1S/C10H21NO2S/c1-3-8-14(12,13)11(2)9-10-6-4-5-7-10/h10H,3-9H2,1-2H3
InChIKeyKJOQOQHPOJUNLC-UHFFFAOYSA-N
MW219.35 g/mol
LogP1.85
Rot. Bonds5

About N-(cyclopentylmethyl)-N-methylpropane-1-sulfonamide

N-(cyclopentylmethyl)-N-methylpropane-1-sulfonamide (PubChem CID 62068860) has the molecular formula C10H21NO2S and a molecular weight of 219.35 g/mol. Its IUPAC name is N-(cyclopentylmethyl)-N-methylpropane-1-sulfonamide.

Molecular Properties

Compound NameN-(cyclopentylmethyl)-N-methylpropane-1-sulfonamide
PubChem CID62068860
Molecular FormulaC10H21NO2S
Molecular Weight219.35 g/mol
Exact Mass219.13
IUPAC NameN-(cyclopentylmethyl)-N-methylpropane-1-sulfonamide
SMILESCCCS(=O)(=O)N(C)CC1CCCC1
InChIInChI=1S/C10H21NO2S/c1-3-8-14(12,13)11(2)9-10-6-4-5-7-10/h10H,3-9H2,1-2H3
InChIKeyKJOQOQHPOJUNLC-UHFFFAOYSA-N
XLogP1.85
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.35
LogP ≤ 51.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(cyclopentylmethyl)-N-methylpropane-1-sulfonamide?
The IUPAC name of N-(cyclopentylmethyl)-N-methylpropane-1-sulfonamide (CID 62068860) is N-(cyclopentylmethyl)-N-methylpropane-1-sulfonamide.
What is the SMILES notation for N-(cyclopentylmethyl)-N-methylpropane-1-sulfonamide?
The canonical SMILES for N-(cyclopentylmethyl)-N-methylpropane-1-sulfonamide is CCCS(=O)(=O)N(C)CC1CCCC1.
What is the InChIKey of N-(cyclopentylmethyl)-N-methylpropane-1-sulfonamide?
The InChIKey is KJOQOQHPOJUNLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2S/c1-3-8-14(12,13)11(2)9-10-6-4-5-7-10/h10H,3-9H2,1-2H3.
What are the key properties of N-(cyclopentylmethyl)-N-methylpropane-1-sulfonamide?
N-(cyclopentylmethyl)-N-methylpropane-1-sulfonamide has a molecular weight of 219.35 g/mol, XLogP of 1.85, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopentylmethyl)-N-methylpropane-1-sulfonamide is sourced from PubChem (CID 62068860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).