[1-(3,4-dimethylcyclohexyl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine

C12H23F3N2O — CID 103217541

IUPAC[1-(3,4-dimethylcyclohexyl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine
SMILESCC1CCC(C(COCC(F)(F)F)NN)CC1C
InChIInChI=1S/C12H23F3N2O/c1-8-3-4-10(5-9(8)2)11(17-16)6-18-7-12(13,14)15/h8-11,17H,3-7,16H2,1-2H3
InChIKeySVFGERKBOIQWQV-UHFFFAOYSA-N
MW268.32 g/mol
LogP2.47
Rot. Bonds5

About [1-(3,4-dimethylcyclohexyl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine

[1-(3,4-dimethylcyclohexyl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine (PubChem CID 103217541) has the molecular formula C12H23F3N2O and a molecular weight of 268.32 g/mol. Its IUPAC name is [1-(3,4-dimethylcyclohexyl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(3,4-dimethylcyclohexyl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine
PubChem CID103217541
Molecular FormulaC12H23F3N2O
Molecular Weight268.32 g/mol
Exact Mass268.18
IUPAC Name[1-(3,4-dimethylcyclohexyl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine
SMILESCC1CCC(C(COCC(F)(F)F)NN)CC1C
InChIInChI=1S/C12H23F3N2O/c1-8-3-4-10(5-9(8)2)11(17-16)6-18-7-12(13,14)15/h8-11,17H,3-7,16H2,1-2H3
InChIKeySVFGERKBOIQWQV-UHFFFAOYSA-N
XLogP2.47
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 52.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [1-(3,4-dimethylcyclohexyl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine?
The IUPAC name of [1-(3,4-dimethylcyclohexyl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine (CID 103217541) is [1-(3,4-dimethylcyclohexyl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine.
What is the SMILES notation for [1-(3,4-dimethylcyclohexyl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine?
The canonical SMILES for [1-(3,4-dimethylcyclohexyl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine is CC1CCC(C(COCC(F)(F)F)NN)CC1C.
What is the InChIKey of [1-(3,4-dimethylcyclohexyl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine?
The InChIKey is SVFGERKBOIQWQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23F3N2O/c1-8-3-4-10(5-9(8)2)11(17-16)6-18-7-12(13,14)15/h8-11,17H,3-7,16H2,1-2H3.
What are the key properties of [1-(3,4-dimethylcyclohexyl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine?
[1-(3,4-dimethylcyclohexyl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine has a molecular weight of 268.32 g/mol, XLogP of 2.47, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3,4-dimethylcyclohexyl)-2-(2,2,2-trifluoroethoxy)ethyl]hydrazine is sourced from PubChem (CID 103217541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).