N-cyclopropyl-4-methylbenzenesulfonamide

C10H13NO2S — CID 4190095

IUPACN-cyclopropyl-4-methylbenzenesulfonamide
SMILESCc1ccc(S(=O)(=O)NC2CC2)cc1
InChIInChI=1S/C10H13NO2S/c1-8-2-6-10(7-3-8)14(12,13)11-9-4-5-9/h2-3,6-7,9,11H,4-5H2,1H3
InChIKeyPFGWZABBMVYDBP-UHFFFAOYSA-N
MW211.29 g/mol
LogP1.44
Rot. Bonds3

About N-cyclopropyl-4-methylbenzenesulfonamide

N-cyclopropyl-4-methylbenzenesulfonamide (PubChem CID 4190095) has the molecular formula C10H13NO2S and a molecular weight of 211.29 g/mol. Its IUPAC name is N-cyclopropyl-4-methylbenzenesulfonamide.

Molecular Properties

Compound NameN-cyclopropyl-4-methylbenzenesulfonamide
PubChem CID4190095
Molecular FormulaC10H13NO2S
Molecular Weight211.29 g/mol
Exact Mass211.07
IUPAC NameN-cyclopropyl-4-methylbenzenesulfonamide
SMILESCc1ccc(S(=O)(=O)NC2CC2)cc1
InChIInChI=1S/C10H13NO2S/c1-8-2-6-10(7-3-8)14(12,13)11-9-4-5-9/h2-3,6-7,9,11H,4-5H2,1H3
InChIKeyPFGWZABBMVYDBP-UHFFFAOYSA-N
XLogP1.44
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 ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-4-methylbenzenesulfonamide?
The IUPAC name of N-cyclopropyl-4-methylbenzenesulfonamide (CID 4190095) is N-cyclopropyl-4-methylbenzenesulfonamide.
What is the SMILES notation for N-cyclopropyl-4-methylbenzenesulfonamide?
The canonical SMILES for N-cyclopropyl-4-methylbenzenesulfonamide is Cc1ccc(S(=O)(=O)NC2CC2)cc1.
What is the InChIKey of N-cyclopropyl-4-methylbenzenesulfonamide?
The InChIKey is PFGWZABBMVYDBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO2S/c1-8-2-6-10(7-3-8)14(12,13)11-9-4-5-9/h2-3,6-7,9,11H,4-5H2,1H3.
What are the key properties of N-cyclopropyl-4-methylbenzenesulfonamide?
N-cyclopropyl-4-methylbenzenesulfonamide has a molecular weight of 211.29 g/mol, XLogP of 1.44, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-4-methylbenzenesulfonamide is sourced from PubChem (CID 4190095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).