cyclohexyl(trifluoromethylsulfonyl)azanide

C7H11F3NO2S- — CID 140579223

IUPACcyclohexyl(trifluoromethylsulfonyl)azanide
SMILESO=S(=O)([N-]C1CCCCC1)C(F)(F)F
InChIInChI=1S/C7H11F3NO2S/c8-7(9,10)14(12,13)11-6-4-2-1-3-5-6/h6H,1-5H2/q-1
InChIKeyVDZPTZITAIXISC-UHFFFAOYSA-N
MW230.23 g/mol
LogP2.54
Rot. Bonds2

About cyclohexyl(trifluoromethylsulfonyl)azanide

cyclohexyl(trifluoromethylsulfonyl)azanide (PubChem CID 140579223) has the molecular formula C7H11F3NO2S- and a molecular weight of 230.23 g/mol. Its IUPAC name is cyclohexyl(trifluoromethylsulfonyl)azanide.

Molecular Properties

Compound Namecyclohexyl(trifluoromethylsulfonyl)azanide
PubChem CID140579223
Molecular FormulaC7H11F3NO2S-
Molecular Weight230.23 g/mol
Exact Mass230.05
IUPAC Namecyclohexyl(trifluoromethylsulfonyl)azanide
SMILESO=S(=O)([N-]C1CCCCC1)C(F)(F)F
InChIInChI=1S/C7H11F3NO2S/c8-7(9,10)14(12,13)11-6-4-2-1-3-5-6/h6H,1-5H2/q-1
InChIKeyVDZPTZITAIXISC-UHFFFAOYSA-N
XLogP2.54
TPSA48.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.23
LogP ≤ 52.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of cyclohexyl(trifluoromethylsulfonyl)azanide?
The IUPAC name of cyclohexyl(trifluoromethylsulfonyl)azanide (CID 140579223) is cyclohexyl(trifluoromethylsulfonyl)azanide.
What is the SMILES notation for cyclohexyl(trifluoromethylsulfonyl)azanide?
The canonical SMILES for cyclohexyl(trifluoromethylsulfonyl)azanide is O=S(=O)([N-]C1CCCCC1)C(F)(F)F.
What is the InChIKey of cyclohexyl(trifluoromethylsulfonyl)azanide?
The InChIKey is VDZPTZITAIXISC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11F3NO2S/c8-7(9,10)14(12,13)11-6-4-2-1-3-5-6/h6H,1-5H2/q-1.
What are the key properties of cyclohexyl(trifluoromethylsulfonyl)azanide?
cyclohexyl(trifluoromethylsulfonyl)azanide has a molecular weight of 230.23 g/mol, XLogP of 2.54, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyl(trifluoromethylsulfonyl)azanide is sourced from PubChem (CID 140579223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).