4-ethyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzenesulfonamide

C19H30N2O3S — CID 9397008

IUPAC4-ethyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzenesulfonamide
SMILESCCc1ccc(S(=O)(=O)NCC2(N3CCOCC3)CCCCC2)cc1
InChIInChI=1S/C19H30N2O3S/c1-2-17-6-8-18(9-7-17)25(22,23)20-16-19(10-4-3-5-11-19)21-12-14-24-15-13-21/h6-9,20H,2-5,10-16H2,1H3
InChIKeyBWZACQXXRDSVTG-UHFFFAOYSA-N
MW366.53 g/mol
LogP2.56
Rot. Bonds6

About 4-ethyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzenesulfonamide

4-ethyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzenesulfonamide (PubChem CID 9397008) has the molecular formula C19H30N2O3S and a molecular weight of 366.53 g/mol. Its IUPAC name is 4-ethyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzenesulfonamide.

Molecular Properties

Compound Name4-ethyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzenesulfonamide
PubChem CID9397008
Molecular FormulaC19H30N2O3S
Molecular Weight366.53 g/mol
Exact Mass366.20
IUPAC Name4-ethyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzenesulfonamide
SMILESCCc1ccc(S(=O)(=O)NCC2(N3CCOCC3)CCCCC2)cc1
InChIInChI=1S/C19H30N2O3S/c1-2-17-6-8-18(9-7-17)25(22,23)20-16-19(10-4-3-5-11-19)21-12-14-24-15-13-21/h6-9,20H,2-5,10-16H2,1H3
InChIKeyBWZACQXXRDSVTG-UHFFFAOYSA-N
XLogP2.56
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.53
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-Cyclohexyl-3-(2-morpholinoethyl)carbodiimide metho-p-toluenesulfonate
CID 17220
4-{4''-[2-((R)-2-Methyl-pyrrolidin-1-yl)-ethyl]-biphenyl-4-sulfonyl}-morpholine
CID 24886365
1-Morpholino-2-(p-toluenesulfonyl)aminoethane
CID 567713
3,5-dimethyl-4-[4-[4-[2-[(2R)-2-methylpyrrolidin-1-yl]ethyl]phenyl]phenyl]sulfonylmorpholine
CID 44254219
4-(4-Biphenylylsulfonyl)morpholine
CID 823364
[4-(Morpholine-4-sulfonyl)phenyl]methanamine
CID 4962072
3,4-dimethyl-N-(2-morpholinoethyl)benzenesulfonamide
CID 646290
N-tert-Butyl-4-(3-morpholin-4-yl-3-oxo-propyl)-benzenesulfonamide
CID 651639
N-cyclohexyl-4-methyl-N-[2-(morpholin-4-yl)-2-oxoethyl]benzenesulfonamide
CID 1154655
3,4-dimethyl-N-[3-(4-morpholinyl)propyl]benzenesulfonamide
CID 2273146
N-(1-methyl-2-morpholin-4-yl-1-phenylethyl)benzenesulfonamide
CID 2997917
2-chloro-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzenesulfonamide
CID 8351272

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzenesulfonamide?
The IUPAC name of 4-ethyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzenesulfonamide (CID 9397008) is 4-ethyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzenesulfonamide.
What is the SMILES notation for 4-ethyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzenesulfonamide?
The canonical SMILES for 4-ethyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzenesulfonamide is CCc1ccc(S(=O)(=O)NCC2(N3CCOCC3)CCCCC2)cc1.
What is the InChIKey of 4-ethyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzenesulfonamide?
The InChIKey is BWZACQXXRDSVTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N2O3S/c1-2-17-6-8-18(9-7-17)25(22,23)20-16-19(10-4-3-5-11-19)21-12-14-24-15-13-21/h6-9,20H,2-5,10-16H2,1H3.
What are the key properties of 4-ethyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzenesulfonamide?
4-ethyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzenesulfonamide has a molecular weight of 366.53 g/mol, XLogP of 2.56, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzenesulfonamide is sourced from PubChem (CID 9397008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).