N-(1-methylcyclopropyl)propane-2-sulfonamide

C7H15NO2S — CID 115634612

IUPACN-(1-methylcyclopropyl)propane-2-sulfonamide
SMILESCC(C)S(=O)(=O)NC1(C)CC1
InChIInChI=1S/C7H15NO2S/c1-6(2)11(9,10)8-7(3)4-5-7/h6,8H,4-5H2,1-3H3
InChIKeyPZVHDHKYGPJYHD-UHFFFAOYSA-N
MW177.27 g/mol
LogP0.87
Rot. Bonds3

About N-(1-methylcyclopropyl)propane-2-sulfonamide

N-(1-methylcyclopropyl)propane-2-sulfonamide (PubChem CID 115634612) has the molecular formula C7H15NO2S and a molecular weight of 177.27 g/mol. Its IUPAC name is N-(1-methylcyclopropyl)propane-2-sulfonamide.

Molecular Properties

Compound NameN-(1-methylcyclopropyl)propane-2-sulfonamide
PubChem CID115634612
Molecular FormulaC7H15NO2S
Molecular Weight177.27 g/mol
Exact Mass177.08
IUPAC NameN-(1-methylcyclopropyl)propane-2-sulfonamide
SMILESCC(C)S(=O)(=O)NC1(C)CC1
InChIInChI=1S/C7H15NO2S/c1-6(2)11(9,10)8-7(3)4-5-7/h6,8H,4-5H2,1-3H3
InChIKeyPZVHDHKYGPJYHD-UHFFFAOYSA-N
XLogP0.87
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.27
LogP ≤ 50.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(1-methylcyclopropyl)propane-2-sulfonamide?
The IUPAC name of N-(1-methylcyclopropyl)propane-2-sulfonamide (CID 115634612) is N-(1-methylcyclopropyl)propane-2-sulfonamide.
What is the SMILES notation for N-(1-methylcyclopropyl)propane-2-sulfonamide?
The canonical SMILES for N-(1-methylcyclopropyl)propane-2-sulfonamide is CC(C)S(=O)(=O)NC1(C)CC1.
What is the InChIKey of N-(1-methylcyclopropyl)propane-2-sulfonamide?
The InChIKey is PZVHDHKYGPJYHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO2S/c1-6(2)11(9,10)8-7(3)4-5-7/h6,8H,4-5H2,1-3H3.
What are the key properties of N-(1-methylcyclopropyl)propane-2-sulfonamide?
N-(1-methylcyclopropyl)propane-2-sulfonamide has a molecular weight of 177.27 g/mol, XLogP of 0.87, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methylcyclopropyl)propane-2-sulfonamide is sourced from PubChem (CID 115634612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).