[(3,4-difluorophenyl)-(1-ethoxy-4-methylcyclohexyl)methyl]hydrazine

C16H24F2N2O — CID 105277308

IUPAC[(3,4-difluorophenyl)-(1-ethoxy-4-methylcyclohexyl)methyl]hydrazine
SMILESCCOC1(C(NN)c2ccc(F)c(F)c2)CCC(C)CC1
InChIInChI=1S/C16H24F2N2O/c1-3-21-16(8-6-11(2)7-9-16)15(20-19)12-4-5-13(17)14(18)10-12/h4-5,10-11,15,20H,3,6-9,19H2,1-2H3
InChIKeyZCWWQKPVCFENMB-UHFFFAOYSA-N
MW298.38 g/mol
LogP3.45
Rot. Bonds5

About [(3,4-difluorophenyl)-(1-ethoxy-4-methylcyclohexyl)methyl]hydrazine

[(3,4-difluorophenyl)-(1-ethoxy-4-methylcyclohexyl)methyl]hydrazine (PubChem CID 105277308) has the molecular formula C16H24F2N2O and a molecular weight of 298.38 g/mol. Its IUPAC name is [(3,4-difluorophenyl)-(1-ethoxy-4-methylcyclohexyl)methyl]hydrazine.

Molecular Properties

Compound Name[(3,4-difluorophenyl)-(1-ethoxy-4-methylcyclohexyl)methyl]hydrazine
PubChem CID105277308
Molecular FormulaC16H24F2N2O
Molecular Weight298.38 g/mol
Exact Mass298.19
IUPAC Name[(3,4-difluorophenyl)-(1-ethoxy-4-methylcyclohexyl)methyl]hydrazine
SMILESCCOC1(C(NN)c2ccc(F)c(F)c2)CCC(C)CC1
InChIInChI=1S/C16H24F2N2O/c1-3-21-16(8-6-11(2)7-9-16)15(20-19)12-4-5-13(17)14(18)10-12/h4-5,10-11,15,20H,3,6-9,19H2,1-2H3
InChIKeyZCWWQKPVCFENMB-UHFFFAOYSA-N
XLogP3.45
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.38
LogP ≤ 53.45
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 [(3,4-difluorophenyl)-(1-ethoxy-4-methylcyclohexyl)methyl]hydrazine?
The IUPAC name of [(3,4-difluorophenyl)-(1-ethoxy-4-methylcyclohexyl)methyl]hydrazine (CID 105277308) is [(3,4-difluorophenyl)-(1-ethoxy-4-methylcyclohexyl)methyl]hydrazine.
What is the SMILES notation for [(3,4-difluorophenyl)-(1-ethoxy-4-methylcyclohexyl)methyl]hydrazine?
The canonical SMILES for [(3,4-difluorophenyl)-(1-ethoxy-4-methylcyclohexyl)methyl]hydrazine is CCOC1(C(NN)c2ccc(F)c(F)c2)CCC(C)CC1.
What is the InChIKey of [(3,4-difluorophenyl)-(1-ethoxy-4-methylcyclohexyl)methyl]hydrazine?
The InChIKey is ZCWWQKPVCFENMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24F2N2O/c1-3-21-16(8-6-11(2)7-9-16)15(20-19)12-4-5-13(17)14(18)10-12/h4-5,10-11,15,20H,3,6-9,19H2,1-2H3.
What are the key properties of [(3,4-difluorophenyl)-(1-ethoxy-4-methylcyclohexyl)methyl]hydrazine?
[(3,4-difluorophenyl)-(1-ethoxy-4-methylcyclohexyl)methyl]hydrazine has a molecular weight of 298.38 g/mol, XLogP of 3.45, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(3,4-difluorophenyl)-(1-ethoxy-4-methylcyclohexyl)methyl]hydrazine is sourced from PubChem (CID 105277308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).