[1-(1-ethoxy-3-methylcyclohexyl)-5,5,5-trifluoropentyl]hydrazine

C14H27F3N2O — CID 105277713

IUPAC[1-(1-ethoxy-3-methylcyclohexyl)-5,5,5-trifluoropentyl]hydrazine
SMILESCCOC1(C(CCCC(F)(F)F)NN)CCCC(C)C1
InChIInChI=1S/C14H27F3N2O/c1-3-20-13(8-4-6-11(2)10-13)12(19-18)7-5-9-14(15,16)17/h11-12,19H,3-10,18H2,1-2H3
InChIKeyHGMBXNGVLVJAEJ-UHFFFAOYSA-N
MW296.38 g/mol
LogP3.54
Rot. Bonds7

About [1-(1-ethoxy-3-methylcyclohexyl)-5,5,5-trifluoropentyl]hydrazine

[1-(1-ethoxy-3-methylcyclohexyl)-5,5,5-trifluoropentyl]hydrazine (PubChem CID 105277713) has the molecular formula C14H27F3N2O and a molecular weight of 296.38 g/mol. Its IUPAC name is [1-(1-ethoxy-3-methylcyclohexyl)-5,5,5-trifluoropentyl]hydrazine.

Molecular Properties

Compound Name[1-(1-ethoxy-3-methylcyclohexyl)-5,5,5-trifluoropentyl]hydrazine
PubChem CID105277713
Molecular FormulaC14H27F3N2O
Molecular Weight296.38 g/mol
Exact Mass296.21
IUPAC Name[1-(1-ethoxy-3-methylcyclohexyl)-5,5,5-trifluoropentyl]hydrazine
SMILESCCOC1(C(CCCC(F)(F)F)NN)CCCC(C)C1
InChIInChI=1S/C14H27F3N2O/c1-3-20-13(8-4-6-11(2)10-13)12(19-18)7-5-9-14(15,16)17/h11-12,19H,3-10,18H2,1-2H3
InChIKeyHGMBXNGVLVJAEJ-UHFFFAOYSA-N
XLogP3.54
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.38
LogP ≤ 53.54
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-(1-ethoxy-3-methylcyclohexyl)-5,5,5-trifluoropentyl]hydrazine?
The IUPAC name of [1-(1-ethoxy-3-methylcyclohexyl)-5,5,5-trifluoropentyl]hydrazine (CID 105277713) is [1-(1-ethoxy-3-methylcyclohexyl)-5,5,5-trifluoropentyl]hydrazine.
What is the SMILES notation for [1-(1-ethoxy-3-methylcyclohexyl)-5,5,5-trifluoropentyl]hydrazine?
The canonical SMILES for [1-(1-ethoxy-3-methylcyclohexyl)-5,5,5-trifluoropentyl]hydrazine is CCOC1(C(CCCC(F)(F)F)NN)CCCC(C)C1.
What is the InChIKey of [1-(1-ethoxy-3-methylcyclohexyl)-5,5,5-trifluoropentyl]hydrazine?
The InChIKey is HGMBXNGVLVJAEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27F3N2O/c1-3-20-13(8-4-6-11(2)10-13)12(19-18)7-5-9-14(15,16)17/h11-12,19H,3-10,18H2,1-2H3.
What are the key properties of [1-(1-ethoxy-3-methylcyclohexyl)-5,5,5-trifluoropentyl]hydrazine?
[1-(1-ethoxy-3-methylcyclohexyl)-5,5,5-trifluoropentyl]hydrazine has a molecular weight of 296.38 g/mol, XLogP of 3.54, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1-ethoxy-3-methylcyclohexyl)-5,5,5-trifluoropentyl]hydrazine is sourced from PubChem (CID 105277713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).