N-[(1-morpholin-4-ylcyclopropyl)methyl]-4-(trifluoromethyl)cyclohexane-1-sulfonamide

C15H25F3N2O3S — CID 128577521

IUPACN-[(1-morpholin-4-ylcyclopropyl)methyl]-4-(trifluoromethyl)cyclohexane-1-sulfonamide
SMILESO=S(=O)(NCC1(N2CCOCC2)CC1)C1CCC(C(F)(F)F)CC1
InChIInChI=1S/C15H25F3N2O3S/c16-15(17,18)12-1-3-13(4-2-12)24(21,22)19-11-14(5-6-14)20-7-9-23-10-8-20/h12-13,19H,1-11H2
InChIKeyGMCITMLQERDFSS-UHFFFAOYSA-N
MW370.44 g/mol
LogP1.89
Rot. Bonds5

About N-[(1-morpholin-4-ylcyclopropyl)methyl]-4-(trifluoromethyl)cyclohexane-1-sulfonamide

N-[(1-morpholin-4-ylcyclopropyl)methyl]-4-(trifluoromethyl)cyclohexane-1-sulfonamide (PubChem CID 128577521) has the molecular formula C15H25F3N2O3S and a molecular weight of 370.44 g/mol. Its IUPAC name is N-[(1-morpholin-4-ylcyclopropyl)methyl]-4-(trifluoromethyl)cyclohexane-1-sulfonamide.

Molecular Properties

Compound NameN-[(1-morpholin-4-ylcyclopropyl)methyl]-4-(trifluoromethyl)cyclohexane-1-sulfonamide
PubChem CID128577521
Molecular FormulaC15H25F3N2O3S
Molecular Weight370.44 g/mol
Exact Mass370.15
IUPAC NameN-[(1-morpholin-4-ylcyclopropyl)methyl]-4-(trifluoromethyl)cyclohexane-1-sulfonamide
SMILESO=S(=O)(NCC1(N2CCOCC2)CC1)C1CCC(C(F)(F)F)CC1
InChIInChI=1S/C15H25F3N2O3S/c16-15(17,18)12-1-3-13(4-2-12)24(21,22)19-11-14(5-6-14)20-7-9-23-10-8-20/h12-13,19H,1-11H2
InChIKeyGMCITMLQERDFSS-UHFFFAOYSA-N
XLogP1.89
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.44
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(1-morpholin-4-ylcyclohexyl)methyl]propane-1-sulfonamide
CID 78793817
3-fluoro-N-[(1-morpholin-4-ylcyclohexyl)methyl]propane-1-sulfonamide
CID 72112328
N-[(1-morpholin-4-ylcyclohexyl)methyl]butane-1-sulfonamide
CID 35764241

Frequently Asked Questions

What is the IUPAC name of N-[(1-morpholin-4-ylcyclopropyl)methyl]-4-(trifluoromethyl)cyclohexane-1-sulfonamide?
The IUPAC name of N-[(1-morpholin-4-ylcyclopropyl)methyl]-4-(trifluoromethyl)cyclohexane-1-sulfonamide (CID 128577521) is N-[(1-morpholin-4-ylcyclopropyl)methyl]-4-(trifluoromethyl)cyclohexane-1-sulfonamide.
What is the SMILES notation for N-[(1-morpholin-4-ylcyclopropyl)methyl]-4-(trifluoromethyl)cyclohexane-1-sulfonamide?
The canonical SMILES for N-[(1-morpholin-4-ylcyclopropyl)methyl]-4-(trifluoromethyl)cyclohexane-1-sulfonamide is O=S(=O)(NCC1(N2CCOCC2)CC1)C1CCC(C(F)(F)F)CC1.
What is the InChIKey of N-[(1-morpholin-4-ylcyclopropyl)methyl]-4-(trifluoromethyl)cyclohexane-1-sulfonamide?
The InChIKey is GMCITMLQERDFSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25F3N2O3S/c16-15(17,18)12-1-3-13(4-2-12)24(21,22)19-11-14(5-6-14)20-7-9-23-10-8-20/h12-13,19H,1-11H2.
What are the key properties of N-[(1-morpholin-4-ylcyclopropyl)methyl]-4-(trifluoromethyl)cyclohexane-1-sulfonamide?
N-[(1-morpholin-4-ylcyclopropyl)methyl]-4-(trifluoromethyl)cyclohexane-1-sulfonamide has a molecular weight of 370.44 g/mol, XLogP of 1.89, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-morpholin-4-ylcyclopropyl)methyl]-4-(trifluoromethyl)cyclohexane-1-sulfonamide is sourced from PubChem (CID 128577521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).