N-(4,4-difluorocyclohexyl)cyclopropanesulfonamide

C9H15F2NO2S — CID 121021911

IUPACN-(4,4-difluorocyclohexyl)cyclopropanesulfonamide
SMILESO=S(=O)(NC1CCC(F)(F)CC1)C1CC1
InChIInChI=1S/C9H15F2NO2S/c10-9(11)5-3-7(4-6-9)12-15(13,14)8-1-2-8/h7-8,12H,1-6H2
InChIKeyWAHSKOBMFSTMND-UHFFFAOYSA-N
MW239.29 g/mol
LogP1.65
Rot. Bonds3

About N-(4,4-difluorocyclohexyl)cyclopropanesulfonamide

N-(4,4-difluorocyclohexyl)cyclopropanesulfonamide (PubChem CID 121021911) has the molecular formula C9H15F2NO2S and a molecular weight of 239.29 g/mol. Its IUPAC name is N-(4,4-difluorocyclohexyl)cyclopropanesulfonamide.

Molecular Properties

Compound NameN-(4,4-difluorocyclohexyl)cyclopropanesulfonamide
PubChem CID121021911
Molecular FormulaC9H15F2NO2S
Molecular Weight239.29 g/mol
Exact Mass239.08
IUPAC NameN-(4,4-difluorocyclohexyl)cyclopropanesulfonamide
SMILESO=S(=O)(NC1CCC(F)(F)CC1)C1CC1
InChIInChI=1S/C9H15F2NO2S/c10-9(11)5-3-7(4-6-9)12-15(13,14)8-1-2-8/h7-8,12H,1-6H2
InChIKeyWAHSKOBMFSTMND-UHFFFAOYSA-N
XLogP1.65
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.29
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-Cyclohexyl-1,1,2,2,3,3,4,4,4-nonafluoro-1-butanesulfonamide
CID 23462806
N-cyclohexyl-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctane-1-sulfonamide
CID 21418863
N-cyclohexylcyclopropanesulfonamide
CID 49715026
N-cyclohexyl-3-fluoropropane-1-sulfonamide
CID 129397177
N-cyclohexyl-1,1-difluoroethanesulfonamide
CID 118150833
3,3,3-trifluoro-N-(4-thionitrosocyclohexyl)propane-1-sulfonamide
CID 122503482
N-cyclohexyl-1-fluoroethanesulfonamide
CID 123992888
N-cyclohexyl-1,1,2,2,3,3,3-heptafluoropropane-1-sulfonamide
CID 129294965
N-cyclohexyl-1,1,2,2,2-pentafluoroethanesulfonamide
CID 129294969
Rel-N-((1r,4r)-4-aminocyclohexyl)-3,3,3-trifluoropropane-1-sulfonamide
CID 138525563
4-(1,1,2,2,3,3,4,4,4-Nonafluorobutylsulfonylamino)cyclohexane-1-sulfonate
CID 145817832
N-cyclohexyl-1,1,2,2,3,3-hexafluorobutane-1-sulfonamide
CID 149295136

Frequently Asked Questions

What is the IUPAC name of N-(4,4-difluorocyclohexyl)cyclopropanesulfonamide?
The IUPAC name of N-(4,4-difluorocyclohexyl)cyclopropanesulfonamide (CID 121021911) is N-(4,4-difluorocyclohexyl)cyclopropanesulfonamide.
What is the SMILES notation for N-(4,4-difluorocyclohexyl)cyclopropanesulfonamide?
The canonical SMILES for N-(4,4-difluorocyclohexyl)cyclopropanesulfonamide is O=S(=O)(NC1CCC(F)(F)CC1)C1CC1.
What is the InChIKey of N-(4,4-difluorocyclohexyl)cyclopropanesulfonamide?
The InChIKey is WAHSKOBMFSTMND-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15F2NO2S/c10-9(11)5-3-7(4-6-9)12-15(13,14)8-1-2-8/h7-8,12H,1-6H2.
What are the key properties of N-(4,4-difluorocyclohexyl)cyclopropanesulfonamide?
N-(4,4-difluorocyclohexyl)cyclopropanesulfonamide has a molecular weight of 239.29 g/mol, XLogP of 1.65, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,4-difluorocyclohexyl)cyclopropanesulfonamide is sourced from PubChem (CID 121021911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).