N-cyclohexyl-4-methyl-N-(2-morpholin-4-yl-2-oxoethyl)benzenesulfonamide

C19H28N2O4S — CID 1154655

IUPACN-cyclohexyl-4-methyl-N-(2-morpholin-4-yl-2-oxoethyl)benzenesulfonamide
SMILESCc1ccc(S(=O)(=O)N(CC(=O)N2CCOCC2)C2CCCCC2)cc1
InChIInChI=1S/C19H28N2O4S/c1-16-7-9-18(10-8-16)26(23,24)21(17-5-3-2-4-6-17)15-19(22)20-11-13-25-14-12-20/h7-10,17H,2-6,11-15H2,1H3
InChIKeyJQUBHFNCOIOHCK-UHFFFAOYSA-N
MW380.51 g/mol
LogP2.18
Rot. Bonds5

About N-cyclohexyl-4-methyl-N-(2-morpholin-4-yl-2-oxoethyl)benzenesulfonamide

N-cyclohexyl-4-methyl-N-(2-morpholin-4-yl-2-oxoethyl)benzenesulfonamide (PubChem CID 1154655) has the molecular formula C19H28N2O4S and a molecular weight of 380.51 g/mol. Its IUPAC name is N-cyclohexyl-4-methyl-N-(2-morpholin-4-yl-2-oxoethyl)benzenesulfonamide.

Molecular Properties

Compound NameN-cyclohexyl-4-methyl-N-(2-morpholin-4-yl-2-oxoethyl)benzenesulfonamide
PubChem CID1154655
Molecular FormulaC19H28N2O4S
Molecular Weight380.51 g/mol
Exact Mass380.18
IUPAC NameN-cyclohexyl-4-methyl-N-(2-morpholin-4-yl-2-oxoethyl)benzenesulfonamide
SMILESCc1ccc(S(=O)(=O)N(CC(=O)N2CCOCC2)C2CCCCC2)cc1
InChIInChI=1S/C19H28N2O4S/c1-16-7-9-18(10-8-16)26(23,24)21(17-5-3-2-4-6-17)15-19(22)20-11-13-25-14-12-20/h7-10,17H,2-6,11-15H2,1H3
InChIKeyJQUBHFNCOIOHCK-UHFFFAOYSA-N
XLogP2.18
TPSA66.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.51
LogP ≤ 52.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-4-methyl-N-(2-morpholin-4-yl-2-oxoethyl)benzenesulfonamide?
The IUPAC name of N-cyclohexyl-4-methyl-N-(2-morpholin-4-yl-2-oxoethyl)benzenesulfonamide (CID 1154655) is N-cyclohexyl-4-methyl-N-(2-morpholin-4-yl-2-oxoethyl)benzenesulfonamide.
What is the SMILES notation for N-cyclohexyl-4-methyl-N-(2-morpholin-4-yl-2-oxoethyl)benzenesulfonamide?
The canonical SMILES for N-cyclohexyl-4-methyl-N-(2-morpholin-4-yl-2-oxoethyl)benzenesulfonamide is Cc1ccc(S(=O)(=O)N(CC(=O)N2CCOCC2)C2CCCCC2)cc1.
What is the InChIKey of N-cyclohexyl-4-methyl-N-(2-morpholin-4-yl-2-oxoethyl)benzenesulfonamide?
The InChIKey is JQUBHFNCOIOHCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N2O4S/c1-16-7-9-18(10-8-16)26(23,24)21(17-5-3-2-4-6-17)15-19(22)20-11-13-25-14-12-20/h7-10,17H,2-6,11-15H2,1H3.
What are the key properties of N-cyclohexyl-4-methyl-N-(2-morpholin-4-yl-2-oxoethyl)benzenesulfonamide?
N-cyclohexyl-4-methyl-N-(2-morpholin-4-yl-2-oxoethyl)benzenesulfonamide has a molecular weight of 380.51 g/mol, XLogP of 2.18, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-4-methyl-N-(2-morpholin-4-yl-2-oxoethyl)benzenesulfonamide is sourced from PubChem (CID 1154655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).