[1-(3-ethoxycyclobutyl)-4-methylpent-4-en-2-yl]hydrazine

C12H24N2O — CID 103170645

IUPAC[1-(3-ethoxycyclobutyl)-4-methylpent-4-en-2-yl]hydrazine
SMILESC=C(C)CC(CC1CC(OCC)C1)NN
InChIInChI=1S/C12H24N2O/c1-4-15-12-7-10(8-12)6-11(14-13)5-9(2)3/h10-12,14H,2,4-8,13H2,1,3H3
InChIKeyWIHGQXXDOMPBJA-UHFFFAOYSA-N
MW212.34 g/mol
LogP1.99
Rot. Bonds7

About [1-(3-ethoxycyclobutyl)-4-methylpent-4-en-2-yl]hydrazine

[1-(3-ethoxycyclobutyl)-4-methylpent-4-en-2-yl]hydrazine (PubChem CID 103170645) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is [1-(3-ethoxycyclobutyl)-4-methylpent-4-en-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(3-ethoxycyclobutyl)-4-methylpent-4-en-2-yl]hydrazine
PubChem CID103170645
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name[1-(3-ethoxycyclobutyl)-4-methylpent-4-en-2-yl]hydrazine
SMILESC=C(C)CC(CC1CC(OCC)C1)NN
InChIInChI=1S/C12H24N2O/c1-4-15-12-7-10(8-12)6-11(14-13)5-9(2)3/h10-12,14H,2,4-8,13H2,1,3H3
InChIKeyWIHGQXXDOMPBJA-UHFFFAOYSA-N
XLogP1.99
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.99
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-(3-ethoxycyclobutyl)-4-methylpent-4-en-2-yl]hydrazine?
The IUPAC name of [1-(3-ethoxycyclobutyl)-4-methylpent-4-en-2-yl]hydrazine (CID 103170645) is [1-(3-ethoxycyclobutyl)-4-methylpent-4-en-2-yl]hydrazine.
What is the SMILES notation for [1-(3-ethoxycyclobutyl)-4-methylpent-4-en-2-yl]hydrazine?
The canonical SMILES for [1-(3-ethoxycyclobutyl)-4-methylpent-4-en-2-yl]hydrazine is C=C(C)CC(CC1CC(OCC)C1)NN.
What is the InChIKey of [1-(3-ethoxycyclobutyl)-4-methylpent-4-en-2-yl]hydrazine?
The InChIKey is WIHGQXXDOMPBJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-4-15-12-7-10(8-12)6-11(14-13)5-9(2)3/h10-12,14H,2,4-8,13H2,1,3H3.
What are the key properties of [1-(3-ethoxycyclobutyl)-4-methylpent-4-en-2-yl]hydrazine?
[1-(3-ethoxycyclobutyl)-4-methylpent-4-en-2-yl]hydrazine has a molecular weight of 212.34 g/mol, XLogP of 1.99, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-ethoxycyclobutyl)-4-methylpent-4-en-2-yl]hydrazine is sourced from PubChem (CID 103170645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).