cyclohexylmethyl(2,2,2-trifluoroethyl)azanide

C9H15F3N- — CID 58040797

IUPACcyclohexylmethyl(2,2,2-trifluoroethyl)azanide
SMILESFC(F)(F)C[N-]CC1CCCCC1
InChIInChI=1S/C9H15F3N/c10-9(11,12)7-13-6-8-4-2-1-3-5-8/h8H,1-7H2/q-1
InChIKeyAIBONUGNKUAFIK-UHFFFAOYSA-N
MW194.22 g/mol
LogP3.50
Rot. Bonds3

About cyclohexylmethyl(2,2,2-trifluoroethyl)azanide

cyclohexylmethyl(2,2,2-trifluoroethyl)azanide (PubChem CID 58040797) has the molecular formula C9H15F3N- and a molecular weight of 194.22 g/mol. Its IUPAC name is cyclohexylmethyl(2,2,2-trifluoroethyl)azanide.

Molecular Properties

Compound Namecyclohexylmethyl(2,2,2-trifluoroethyl)azanide
PubChem CID58040797
Molecular FormulaC9H15F3N-
Molecular Weight194.22 g/mol
Exact Mass194.12
IUPAC Namecyclohexylmethyl(2,2,2-trifluoroethyl)azanide
SMILESFC(F)(F)C[N-]CC1CCCCC1
InChIInChI=1S/C9H15F3N/c10-9(11,12)7-13-6-8-4-2-1-3-5-8/h8H,1-7H2/q-1
InChIKeyAIBONUGNKUAFIK-UHFFFAOYSA-N
XLogP3.50
TPSA14.10 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.22
LogP ≤ 53.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of cyclohexylmethyl(2,2,2-trifluoroethyl)azanide?
The IUPAC name of cyclohexylmethyl(2,2,2-trifluoroethyl)azanide (CID 58040797) is cyclohexylmethyl(2,2,2-trifluoroethyl)azanide.
What is the SMILES notation for cyclohexylmethyl(2,2,2-trifluoroethyl)azanide?
The canonical SMILES for cyclohexylmethyl(2,2,2-trifluoroethyl)azanide is FC(F)(F)C[N-]CC1CCCCC1.
What is the InChIKey of cyclohexylmethyl(2,2,2-trifluoroethyl)azanide?
The InChIKey is AIBONUGNKUAFIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15F3N/c10-9(11,12)7-13-6-8-4-2-1-3-5-8/h8H,1-7H2/q-1.
What are the key properties of cyclohexylmethyl(2,2,2-trifluoroethyl)azanide?
cyclohexylmethyl(2,2,2-trifluoroethyl)azanide has a molecular weight of 194.22 g/mol, XLogP of 3.50, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexylmethyl(2,2,2-trifluoroethyl)azanide is sourced from PubChem (CID 58040797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).