N-(1-methylcyclopropyl)benzenesulfonamide

C10H13NO2S — CID 67608807

IUPACN-(1-methylcyclopropyl)benzenesulfonamide
SMILESCC1(NS(=O)(=O)c2ccccc2)CC1
InChIInChI=1S/C10H13NO2S/c1-10(7-8-10)11-14(12,13)9-5-3-2-4-6-9/h2-6,11H,7-8H2,1H3
InChIKeyXUBFENQELGISEH-UHFFFAOYSA-N
MW211.29 g/mol
LogP1.52
Rot. Bonds3

About N-(1-methylcyclopropyl)benzenesulfonamide

N-(1-methylcyclopropyl)benzenesulfonamide (PubChem CID 67608807) has the molecular formula C10H13NO2S and a molecular weight of 211.29 g/mol. Its IUPAC name is N-(1-methylcyclopropyl)benzenesulfonamide.

Molecular Properties

Compound NameN-(1-methylcyclopropyl)benzenesulfonamide
PubChem CID67608807
Molecular FormulaC10H13NO2S
Molecular Weight211.29 g/mol
Exact Mass211.07
IUPAC NameN-(1-methylcyclopropyl)benzenesulfonamide
SMILESCC1(NS(=O)(=O)c2ccccc2)CC1
InChIInChI=1S/C10H13NO2S/c1-10(7-8-10)11-14(12,13)9-5-3-2-4-6-9/h2-6,11H,7-8H2,1H3
InChIKeyXUBFENQELGISEH-UHFFFAOYSA-N
XLogP1.52
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.29
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(1-methylcyclopropyl)benzenesulfonamide?
The IUPAC name of N-(1-methylcyclopropyl)benzenesulfonamide (CID 67608807) is N-(1-methylcyclopropyl)benzenesulfonamide.
What is the SMILES notation for N-(1-methylcyclopropyl)benzenesulfonamide?
The canonical SMILES for N-(1-methylcyclopropyl)benzenesulfonamide is CC1(NS(=O)(=O)c2ccccc2)CC1.
What is the InChIKey of N-(1-methylcyclopropyl)benzenesulfonamide?
The InChIKey is XUBFENQELGISEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO2S/c1-10(7-8-10)11-14(12,13)9-5-3-2-4-6-9/h2-6,11H,7-8H2,1H3.
What are the key properties of N-(1-methylcyclopropyl)benzenesulfonamide?
N-(1-methylcyclopropyl)benzenesulfonamide has a molecular weight of 211.29 g/mol, XLogP of 1.52, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methylcyclopropyl)benzenesulfonamide is sourced from PubChem (CID 67608807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).