N-cyclopropyl-N-(oxan-4-yl)benzenesulfonamide

C14H19NO3S — CID 110873083

IUPACN-cyclopropyl-N-(oxan-4-yl)benzenesulfonamide
SMILESO=S(=O)(c1ccccc1)N(C1CCOCC1)C1CC1
InChIInChI=1S/C14H19NO3S/c16-19(17,14-4-2-1-3-5-14)15(12-6-7-12)13-8-10-18-11-9-13/h1-5,12-13H,6-11H2
InChIKeyJRYNJRSLOSLUIR-UHFFFAOYSA-N
MW281.38 g/mol
LogP2.02
Rot. Bonds4

About N-cyclopropyl-N-(oxan-4-yl)benzenesulfonamide

N-cyclopropyl-N-(oxan-4-yl)benzenesulfonamide (PubChem CID 110873083) has the molecular formula C14H19NO3S and a molecular weight of 281.38 g/mol. Its IUPAC name is N-cyclopropyl-N-(oxan-4-yl)benzenesulfonamide.

Molecular Properties

Compound NameN-cyclopropyl-N-(oxan-4-yl)benzenesulfonamide
PubChem CID110873083
Molecular FormulaC14H19NO3S
Molecular Weight281.38 g/mol
Exact Mass281.11
IUPAC NameN-cyclopropyl-N-(oxan-4-yl)benzenesulfonamide
SMILESO=S(=O)(c1ccccc1)N(C1CCOCC1)C1CC1
InChIInChI=1S/C14H19NO3S/c16-19(17,14-4-2-1-3-5-14)15(12-6-7-12)13-8-10-18-11-9-13/h1-5,12-13H,6-11H2
InChIKeyJRYNJRSLOSLUIR-UHFFFAOYSA-N
XLogP2.02
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.38
LogP ≤ 52.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze N-cyclopropyl-N-(oxan-4-yl)benzenesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-(oxan-4-yl)benzenesulfonamide?
The IUPAC name of N-cyclopropyl-N-(oxan-4-yl)benzenesulfonamide (CID 110873083) is N-cyclopropyl-N-(oxan-4-yl)benzenesulfonamide.
What is the SMILES notation for N-cyclopropyl-N-(oxan-4-yl)benzenesulfonamide?
The canonical SMILES for N-cyclopropyl-N-(oxan-4-yl)benzenesulfonamide is O=S(=O)(c1ccccc1)N(C1CCOCC1)C1CC1.
What is the InChIKey of N-cyclopropyl-N-(oxan-4-yl)benzenesulfonamide?
The InChIKey is JRYNJRSLOSLUIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO3S/c16-19(17,14-4-2-1-3-5-14)15(12-6-7-12)13-8-10-18-11-9-13/h1-5,12-13H,6-11H2.
What are the key properties of N-cyclopropyl-N-(oxan-4-yl)benzenesulfonamide?
N-cyclopropyl-N-(oxan-4-yl)benzenesulfonamide has a molecular weight of 281.38 g/mol, XLogP of 2.02, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-(oxan-4-yl)benzenesulfonamide is sourced from PubChem (CID 110873083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).