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

C11H22N2O — CID 103560512

IUPAC[1-(1-methoxycyclobutyl)-4-methylpent-4-en-2-yl]hydrazine
SMILESC=C(C)CC(CC1(OC)CCC1)NN
InChIInChI=1S/C11H22N2O/c1-9(2)7-10(13-12)8-11(14-3)5-4-6-11/h10,13H,1,4-8,12H2,2-3H3
InChIKeyBTWDJTUTCDHUBU-UHFFFAOYSA-N
MW198.31 g/mol
LogP1.74
Rot. Bonds6

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

[1-(1-methoxycyclobutyl)-4-methylpent-4-en-2-yl]hydrazine (PubChem CID 103560512) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is [1-(1-methoxycyclobutyl)-4-methylpent-4-en-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(1-methoxycyclobutyl)-4-methylpent-4-en-2-yl]hydrazine
PubChem CID103560512
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name[1-(1-methoxycyclobutyl)-4-methylpent-4-en-2-yl]hydrazine
SMILESC=C(C)CC(CC1(OC)CCC1)NN
InChIInChI=1S/C11H22N2O/c1-9(2)7-10(13-12)8-11(14-3)5-4-6-11/h10,13H,1,4-8,12H2,2-3H3
InChIKeyBTWDJTUTCDHUBU-UHFFFAOYSA-N
XLogP1.74
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 51.74
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-(1-methoxycyclobutyl)-4-methylpent-4-en-2-yl]hydrazine?
The IUPAC name of [1-(1-methoxycyclobutyl)-4-methylpent-4-en-2-yl]hydrazine (CID 103560512) is [1-(1-methoxycyclobutyl)-4-methylpent-4-en-2-yl]hydrazine.
What is the SMILES notation for [1-(1-methoxycyclobutyl)-4-methylpent-4-en-2-yl]hydrazine?
The canonical SMILES for [1-(1-methoxycyclobutyl)-4-methylpent-4-en-2-yl]hydrazine is C=C(C)CC(CC1(OC)CCC1)NN.
What is the InChIKey of [1-(1-methoxycyclobutyl)-4-methylpent-4-en-2-yl]hydrazine?
The InChIKey is BTWDJTUTCDHUBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-9(2)7-10(13-12)8-11(14-3)5-4-6-11/h10,13H,1,4-8,12H2,2-3H3.
What are the key properties of [1-(1-methoxycyclobutyl)-4-methylpent-4-en-2-yl]hydrazine?
[1-(1-methoxycyclobutyl)-4-methylpent-4-en-2-yl]hydrazine has a molecular weight of 198.31 g/mol, XLogP of 1.74, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1-methoxycyclobutyl)-4-methylpent-4-en-2-yl]hydrazine is sourced from PubChem (CID 103560512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).