[1-(cycloocten-1-yl)-2-(3-ethoxycyclobutyl)ethyl]hydrazine

C16H30N2O — CID 106650040

IUPAC[1-(cycloocten-1-yl)-2-(3-ethoxycyclobutyl)ethyl]hydrazine
SMILESCCOC1CC(CC(NN)C2=CCCCCCC2)C1
InChIInChI=1S/C16H30N2O/c1-2-19-15-10-13(11-15)12-16(18-17)14-8-6-4-3-5-7-9-14/h8,13,15-16,18H,2-7,9-12,17H2,1H3
InChIKeyGEQIREUMFCJYLE-UHFFFAOYSA-N
MW266.43 g/mol
LogP3.30
Rot. Bonds6

About [1-(cycloocten-1-yl)-2-(3-ethoxycyclobutyl)ethyl]hydrazine

[1-(cycloocten-1-yl)-2-(3-ethoxycyclobutyl)ethyl]hydrazine (PubChem CID 106650040) has the molecular formula C16H30N2O and a molecular weight of 266.43 g/mol. Its IUPAC name is [1-(cycloocten-1-yl)-2-(3-ethoxycyclobutyl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(cycloocten-1-yl)-2-(3-ethoxycyclobutyl)ethyl]hydrazine
PubChem CID106650040
Molecular FormulaC16H30N2O
Molecular Weight266.43 g/mol
Exact Mass266.24
IUPAC Name[1-(cycloocten-1-yl)-2-(3-ethoxycyclobutyl)ethyl]hydrazine
SMILESCCOC1CC(CC(NN)C2=CCCCCCC2)C1
InChIInChI=1S/C16H30N2O/c1-2-19-15-10-13(11-15)12-16(18-17)14-8-6-4-3-5-7-9-14/h8,13,15-16,18H,2-7,9-12,17H2,1H3
InChIKeyGEQIREUMFCJYLE-UHFFFAOYSA-N
XLogP3.30
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 53.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', '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-(cycloocten-1-yl)-2-(3-ethoxycyclobutyl)ethyl]hydrazine?
The IUPAC name of [1-(cycloocten-1-yl)-2-(3-ethoxycyclobutyl)ethyl]hydrazine (CID 106650040) is [1-(cycloocten-1-yl)-2-(3-ethoxycyclobutyl)ethyl]hydrazine.
What is the SMILES notation for [1-(cycloocten-1-yl)-2-(3-ethoxycyclobutyl)ethyl]hydrazine?
The canonical SMILES for [1-(cycloocten-1-yl)-2-(3-ethoxycyclobutyl)ethyl]hydrazine is CCOC1CC(CC(NN)C2=CCCCCCC2)C1.
What is the InChIKey of [1-(cycloocten-1-yl)-2-(3-ethoxycyclobutyl)ethyl]hydrazine?
The InChIKey is GEQIREUMFCJYLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O/c1-2-19-15-10-13(11-15)12-16(18-17)14-8-6-4-3-5-7-9-14/h8,13,15-16,18H,2-7,9-12,17H2,1H3.
What are the key properties of [1-(cycloocten-1-yl)-2-(3-ethoxycyclobutyl)ethyl]hydrazine?
[1-(cycloocten-1-yl)-2-(3-ethoxycyclobutyl)ethyl]hydrazine has a molecular weight of 266.43 g/mol, XLogP of 3.30, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(cycloocten-1-yl)-2-(3-ethoxycyclobutyl)ethyl]hydrazine is sourced from PubChem (CID 106650040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).