4-cyclohexyl-N-(2-morpholin-4-ylethyl)benzenesulfonamide

C18H28N2O3S — CID 7731314

IUPAC4-cyclohexyl-N-(2-morpholin-4-ylethyl)benzenesulfonamide
SMILESO=S(=O)(NCCN1CCOCC1)c1ccc(C2CCCCC2)cc1
InChIInChI=1S/C18H28N2O3S/c21-24(22,19-10-11-20-12-14-23-15-13-20)18-8-6-17(7-9-18)16-4-2-1-3-5-16/h6-9,16,19H,1-5,10-15H2
InChIKeyMSBZLNUJLDBCQS-UHFFFAOYSA-N
MW352.50 g/mol
LogP2.34
Rot. Bonds6

About 4-cyclohexyl-N-(2-morpholin-4-ylethyl)benzenesulfonamide

4-cyclohexyl-N-(2-morpholin-4-ylethyl)benzenesulfonamide (PubChem CID 7731314) has the molecular formula C18H28N2O3S and a molecular weight of 352.50 g/mol. Its IUPAC name is 4-cyclohexyl-N-(2-morpholin-4-ylethyl)benzenesulfonamide.

Molecular Properties

Compound Name4-cyclohexyl-N-(2-morpholin-4-ylethyl)benzenesulfonamide
PubChem CID7731314
Molecular FormulaC18H28N2O3S
Molecular Weight352.50 g/mol
Exact Mass352.18
IUPAC Name4-cyclohexyl-N-(2-morpholin-4-ylethyl)benzenesulfonamide
SMILESO=S(=O)(NCCN1CCOCC1)c1ccc(C2CCCCC2)cc1
InChIInChI=1S/C18H28N2O3S/c21-24(22,19-10-11-20-12-14-23-15-13-20)18-8-6-17(7-9-18)16-4-2-1-3-5-16/h6-9,16,19H,1-5,10-15H2
InChIKeyMSBZLNUJLDBCQS-UHFFFAOYSA-N
XLogP2.34
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.50
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-cyclohexyl-N-(2-morpholin-4-ylethyl)benzenesulfonamide?
The IUPAC name of 4-cyclohexyl-N-(2-morpholin-4-ylethyl)benzenesulfonamide (CID 7731314) is 4-cyclohexyl-N-(2-morpholin-4-ylethyl)benzenesulfonamide.
What is the SMILES notation for 4-cyclohexyl-N-(2-morpholin-4-ylethyl)benzenesulfonamide?
The canonical SMILES for 4-cyclohexyl-N-(2-morpholin-4-ylethyl)benzenesulfonamide is O=S(=O)(NCCN1CCOCC1)c1ccc(C2CCCCC2)cc1.
What is the InChIKey of 4-cyclohexyl-N-(2-morpholin-4-ylethyl)benzenesulfonamide?
The InChIKey is MSBZLNUJLDBCQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O3S/c21-24(22,19-10-11-20-12-14-23-15-13-20)18-8-6-17(7-9-18)16-4-2-1-3-5-16/h6-9,16,19H,1-5,10-15H2.
What are the key properties of 4-cyclohexyl-N-(2-morpholin-4-ylethyl)benzenesulfonamide?
4-cyclohexyl-N-(2-morpholin-4-ylethyl)benzenesulfonamide has a molecular weight of 352.50 g/mol, XLogP of 2.34, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclohexyl-N-(2-morpholin-4-ylethyl)benzenesulfonamide is sourced from PubChem (CID 7731314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).