N-[[1-(methoxymethyl)cyclopentyl]methyl]propane-2-sulfonamide

C11H23NO3S — CID 131946224

IUPACN-[[1-(methoxymethyl)cyclopentyl]methyl]propane-2-sulfonamide
SMILESCOCC1(CNS(=O)(=O)C(C)C)CCCC1
InChIInChI=1S/C11H23NO3S/c1-10(2)16(13,14)12-8-11(9-15-3)6-4-5-7-11/h10,12H,4-9H2,1-3H3
InChIKeyJSUDOAZOEGAIFA-UHFFFAOYSA-N
MW249.38 g/mol
LogP1.52
Rot. Bonds6

About N-[[1-(methoxymethyl)cyclopentyl]methyl]propane-2-sulfonamide

N-[[1-(methoxymethyl)cyclopentyl]methyl]propane-2-sulfonamide (PubChem CID 131946224) has the molecular formula C11H23NO3S and a molecular weight of 249.38 g/mol. Its IUPAC name is N-[[1-(methoxymethyl)cyclopentyl]methyl]propane-2-sulfonamide.

Molecular Properties

Compound NameN-[[1-(methoxymethyl)cyclopentyl]methyl]propane-2-sulfonamide
PubChem CID131946224
Molecular FormulaC11H23NO3S
Molecular Weight249.38 g/mol
Exact Mass249.14
IUPAC NameN-[[1-(methoxymethyl)cyclopentyl]methyl]propane-2-sulfonamide
SMILESCOCC1(CNS(=O)(=O)C(C)C)CCCC1
InChIInChI=1S/C11H23NO3S/c1-10(2)16(13,14)12-8-11(9-15-3)6-4-5-7-11/h10,12H,4-9H2,1-3H3
InChIKeyJSUDOAZOEGAIFA-UHFFFAOYSA-N
XLogP1.52
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.38
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[[1-(methoxymethyl)cyclopentyl]methyl]propane-2-sulfonamide?
The IUPAC name of N-[[1-(methoxymethyl)cyclopentyl]methyl]propane-2-sulfonamide (CID 131946224) is N-[[1-(methoxymethyl)cyclopentyl]methyl]propane-2-sulfonamide.
What is the SMILES notation for N-[[1-(methoxymethyl)cyclopentyl]methyl]propane-2-sulfonamide?
The canonical SMILES for N-[[1-(methoxymethyl)cyclopentyl]methyl]propane-2-sulfonamide is COCC1(CNS(=O)(=O)C(C)C)CCCC1.
What is the InChIKey of N-[[1-(methoxymethyl)cyclopentyl]methyl]propane-2-sulfonamide?
The InChIKey is JSUDOAZOEGAIFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO3S/c1-10(2)16(13,14)12-8-11(9-15-3)6-4-5-7-11/h10,12H,4-9H2,1-3H3.
What are the key properties of N-[[1-(methoxymethyl)cyclopentyl]methyl]propane-2-sulfonamide?
N-[[1-(methoxymethyl)cyclopentyl]methyl]propane-2-sulfonamide has a molecular weight of 249.38 g/mol, XLogP of 1.52, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(methoxymethyl)cyclopentyl]methyl]propane-2-sulfonamide is sourced from PubChem (CID 131946224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).