N-[(1R,3S)-3-(trifluoromethyl)cyclohexyl]morpholine-4-sulfonamide

C11H19F3N2O3S — CID 95266419

IUPACN-[(1R,3S)-3-(trifluoromethyl)cyclohexyl]morpholine-4-sulfonamide
SMILESO=S(=O)(N[C@@H]1CCC[C@H](C(F)(F)F)C1)N1CCOCC1
InChIInChI=1S/C11H19F3N2O3S/c12-11(13,14)9-2-1-3-10(8-9)15-20(17,18)16-4-6-19-7-5-16/h9-10,15H,1-8H2/t9-,10+/m0/s1
InChIKeyTUDZUKGKPMPIDA-VHSXEESVSA-N
MW316.35 g/mol
LogP1.27
Rot. Bonds3

About N-[(1R,3S)-3-(trifluoromethyl)cyclohexyl]morpholine-4-sulfonamide

N-[(1R,3S)-3-(trifluoromethyl)cyclohexyl]morpholine-4-sulfonamide (PubChem CID 95266419) has the molecular formula C11H19F3N2O3S and a molecular weight of 316.35 g/mol. Its IUPAC name is N-[(1R,3S)-3-(trifluoromethyl)cyclohexyl]morpholine-4-sulfonamide.

Molecular Properties

Compound NameN-[(1R,3S)-3-(trifluoromethyl)cyclohexyl]morpholine-4-sulfonamide
PubChem CID95266419
Molecular FormulaC11H19F3N2O3S
Molecular Weight316.35 g/mol
Exact Mass316.11
IUPAC NameN-[(1R,3S)-3-(trifluoromethyl)cyclohexyl]morpholine-4-sulfonamide
SMILESO=S(=O)(N[C@@H]1CCC[C@H](C(F)(F)F)C1)N1CCOCC1
InChIInChI=1S/C11H19F3N2O3S/c12-11(13,14)9-2-1-3-10(8-9)15-20(17,18)16-4-6-19-7-5-16/h9-10,15H,1-8H2/t9-,10+/m0/s1
InChIKeyTUDZUKGKPMPIDA-VHSXEESVSA-N
XLogP1.27
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.35
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1R,3S)-3-(trifluoromethyl)cyclohexyl]methanesulfonamide
CID 129369369
N-[(1R,3R)-3-aminocyclopentyl]morpholine-4-sulfonamide;hydrochloride
CID 154887134
cis-(1R,3S)-1-(dimethylsulfamoylamino)-3-(trifluoromethyl)cyclohexane
CID 95286792
3-morpholin-4-ylsulfonyl-N-[3-(trifluoromethyl)cyclohexyl]thiophene-2-carboxamide
CID 55535803
trans-(1R,3R)-N-[(2S,3R)-3-morpholin-4-ylbutan-2-yl]-3-(trifluoromethyl)cyclohexan-1-amine
CID 129429871
4-[(3R)-3-(trifluoromethyl)piperidin-1-yl]sulfonylmorpholine
CID 94018195
4-[(3S)-3-(trifluoromethyl)piperidin-1-yl]sulfonylmorpholine
CID 94018194
1-methylsulfonyl-N-[3-(trifluoromethyl)cyclohexyl]piperidin-4-amine
CID 64757172
N-[(3S)-pyrrolidin-3-yl]morpholine-4-sulfonamide
CID 79685144
trans-(1R,3R)-3-(trifluoromethyl)-N-[(1R,3S)-3-(trifluoromethyl)cyclohexyl]cyclohexan-1-amine
CID 39870295
N-[4-(hydroxymethyl)cyclohexyl]morpholine-4-sulfonamide
CID 112752969
N-(1,4-dioxaspiro[4.5]decan-8-yl)morpholine-4-sulfonamide
CID 47319516

Frequently Asked Questions

What is the IUPAC name of N-[(1R,3S)-3-(trifluoromethyl)cyclohexyl]morpholine-4-sulfonamide?
The IUPAC name of N-[(1R,3S)-3-(trifluoromethyl)cyclohexyl]morpholine-4-sulfonamide (CID 95266419) is N-[(1R,3S)-3-(trifluoromethyl)cyclohexyl]morpholine-4-sulfonamide.
What is the SMILES notation for N-[(1R,3S)-3-(trifluoromethyl)cyclohexyl]morpholine-4-sulfonamide?
The canonical SMILES for N-[(1R,3S)-3-(trifluoromethyl)cyclohexyl]morpholine-4-sulfonamide is O=S(=O)(N[C@@H]1CCC[C@H](C(F)(F)F)C1)N1CCOCC1.
What is the InChIKey of N-[(1R,3S)-3-(trifluoromethyl)cyclohexyl]morpholine-4-sulfonamide?
The InChIKey is TUDZUKGKPMPIDA-VHSXEESVSA-N. The full InChI is InChI=1S/C11H19F3N2O3S/c12-11(13,14)9-2-1-3-10(8-9)15-20(17,18)16-4-6-19-7-5-16/h9-10,15H,1-8H2/t9-,10+/m0/s1.
What are the key properties of N-[(1R,3S)-3-(trifluoromethyl)cyclohexyl]morpholine-4-sulfonamide?
N-[(1R,3S)-3-(trifluoromethyl)cyclohexyl]morpholine-4-sulfonamide has a molecular weight of 316.35 g/mol, XLogP of 1.27, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R,3S)-3-(trifluoromethyl)cyclohexyl]morpholine-4-sulfonamide is sourced from PubChem (CID 95266419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).