N-cyclopropyl-4-ethoxybenzenesulfonamide

C11H15NO3S — CID 848357

IUPACN-cyclopropyl-4-ethoxybenzenesulfonamide
SMILESCCOc1ccc(S(=O)(=O)NC2CC2)cc1
InChIInChI=1S/C11H15NO3S/c1-2-15-10-5-7-11(8-6-10)16(13,14)12-9-3-4-9/h5-9,12H,2-4H2,1H3
InChIKeyHWQBOXRPRYVKTC-UHFFFAOYSA-N
MW241.31 g/mol
LogP1.53
Rot. Bonds5

About N-cyclopropyl-4-ethoxybenzenesulfonamide

N-cyclopropyl-4-ethoxybenzenesulfonamide (PubChem CID 848357) has the molecular formula C11H15NO3S and a molecular weight of 241.31 g/mol. Its IUPAC name is N-cyclopropyl-4-ethoxybenzenesulfonamide.

Molecular Properties

Compound NameN-cyclopropyl-4-ethoxybenzenesulfonamide
PubChem CID848357
Molecular FormulaC11H15NO3S
Molecular Weight241.31 g/mol
Exact Mass241.08
IUPAC NameN-cyclopropyl-4-ethoxybenzenesulfonamide
SMILESCCOc1ccc(S(=O)(=O)NC2CC2)cc1
InChIInChI=1S/C11H15NO3S/c1-2-15-10-5-7-11(8-6-10)16(13,14)12-9-3-4-9/h5-9,12H,2-4H2,1H3
InChIKeyHWQBOXRPRYVKTC-UHFFFAOYSA-N
XLogP1.53
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.31
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-4-ethoxybenzenesulfonamide?
The IUPAC name of N-cyclopropyl-4-ethoxybenzenesulfonamide (CID 848357) is N-cyclopropyl-4-ethoxybenzenesulfonamide.
What is the SMILES notation for N-cyclopropyl-4-ethoxybenzenesulfonamide?
The canonical SMILES for N-cyclopropyl-4-ethoxybenzenesulfonamide is CCOc1ccc(S(=O)(=O)NC2CC2)cc1.
What is the InChIKey of N-cyclopropyl-4-ethoxybenzenesulfonamide?
The InChIKey is HWQBOXRPRYVKTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO3S/c1-2-15-10-5-7-11(8-6-10)16(13,14)12-9-3-4-9/h5-9,12H,2-4H2,1H3.
What are the key properties of N-cyclopropyl-4-ethoxybenzenesulfonamide?
N-cyclopropyl-4-ethoxybenzenesulfonamide has a molecular weight of 241.31 g/mol, XLogP of 1.53, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-4-ethoxybenzenesulfonamide is sourced from PubChem (CID 848357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).