[(1-ethoxycyclohexyl)-(3-fluorophenyl)methyl]hydrazine

C15H23FN2O — CID 105276324

IUPAC[(1-ethoxycyclohexyl)-(3-fluorophenyl)methyl]hydrazine
SMILESCCOC1(C(NN)c2cccc(F)c2)CCCCC1
InChIInChI=1S/C15H23FN2O/c1-2-19-15(9-4-3-5-10-15)14(18-17)12-7-6-8-13(16)11-12/h6-8,11,14,18H,2-5,9-10,17H2,1H3
InChIKeyCQQNVJJMAKGHKO-UHFFFAOYSA-N
MW266.36 g/mol
LogP3.07
Rot. Bonds5

About [(1-ethoxycyclohexyl)-(3-fluorophenyl)methyl]hydrazine

[(1-ethoxycyclohexyl)-(3-fluorophenyl)methyl]hydrazine (PubChem CID 105276324) has the molecular formula C15H23FN2O and a molecular weight of 266.36 g/mol. Its IUPAC name is [(1-ethoxycyclohexyl)-(3-fluorophenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(1-ethoxycyclohexyl)-(3-fluorophenyl)methyl]hydrazine
PubChem CID105276324
Molecular FormulaC15H23FN2O
Molecular Weight266.36 g/mol
Exact Mass266.18
IUPAC Name[(1-ethoxycyclohexyl)-(3-fluorophenyl)methyl]hydrazine
SMILESCCOC1(C(NN)c2cccc(F)c2)CCCCC1
InChIInChI=1S/C15H23FN2O/c1-2-19-15(9-4-3-5-10-15)14(18-17)12-7-6-8-13(16)11-12/h6-8,11,14,18H,2-5,9-10,17H2,1H3
InChIKeyCQQNVJJMAKGHKO-UHFFFAOYSA-N
XLogP3.07
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.36
LogP ≤ 53.07
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-ethoxycyclohexyl)-(3-fluorophenyl)methyl]hydrazine?
The IUPAC name of [(1-ethoxycyclohexyl)-(3-fluorophenyl)methyl]hydrazine (CID 105276324) is [(1-ethoxycyclohexyl)-(3-fluorophenyl)methyl]hydrazine.
What is the SMILES notation for [(1-ethoxycyclohexyl)-(3-fluorophenyl)methyl]hydrazine?
The canonical SMILES for [(1-ethoxycyclohexyl)-(3-fluorophenyl)methyl]hydrazine is CCOC1(C(NN)c2cccc(F)c2)CCCCC1.
What is the InChIKey of [(1-ethoxycyclohexyl)-(3-fluorophenyl)methyl]hydrazine?
The InChIKey is CQQNVJJMAKGHKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23FN2O/c1-2-19-15(9-4-3-5-10-15)14(18-17)12-7-6-8-13(16)11-12/h6-8,11,14,18H,2-5,9-10,17H2,1H3.
What are the key properties of [(1-ethoxycyclohexyl)-(3-fluorophenyl)methyl]hydrazine?
[(1-ethoxycyclohexyl)-(3-fluorophenyl)methyl]hydrazine has a molecular weight of 266.36 g/mol, XLogP of 3.07, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(1-ethoxycyclohexyl)-(3-fluorophenyl)methyl]hydrazine is sourced from PubChem (CID 105276324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).