[3-methyl-1-(oxolan-2-yl)but-3-en-2-yl]hydrazine

C9H18N2O — CID 105198744

IUPAC[3-methyl-1-(oxolan-2-yl)but-3-en-2-yl]hydrazine
SMILESC=C(C)C(CC1CCCO1)NN
InChIInChI=1S/C9H18N2O/c1-7(2)9(11-10)6-8-4-3-5-12-8/h8-9,11H,1,3-6,10H2,2H3
InChIKeyNZJMXFZMXHKZGL-UHFFFAOYSA-N
MW170.26 g/mol
LogP0.96
Rot. Bonds4

About [3-methyl-1-(oxolan-2-yl)but-3-en-2-yl]hydrazine

[3-methyl-1-(oxolan-2-yl)but-3-en-2-yl]hydrazine (PubChem CID 105198744) has the molecular formula C9H18N2O and a molecular weight of 170.26 g/mol. Its IUPAC name is [3-methyl-1-(oxolan-2-yl)but-3-en-2-yl]hydrazine.

Molecular Properties

Compound Name[3-methyl-1-(oxolan-2-yl)but-3-en-2-yl]hydrazine
PubChem CID105198744
Molecular FormulaC9H18N2O
Molecular Weight170.26 g/mol
Exact Mass170.14
IUPAC Name[3-methyl-1-(oxolan-2-yl)but-3-en-2-yl]hydrazine
SMILESC=C(C)C(CC1CCCO1)NN
InChIInChI=1S/C9H18N2O/c1-7(2)9(11-10)6-8-4-3-5-12-8/h8-9,11H,1,3-6,10H2,2H3
InChIKeyNZJMXFZMXHKZGL-UHFFFAOYSA-N
XLogP0.96
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.26
LogP ≤ 50.96
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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Related Compounds

4-Methylidene-1-(oxolan-2-yl)hexan-2-amine
CID 66044104
4-Methyl-1-(oxolan-2-yl)pent-4-en-2-amine
CID 79179974
3-Methyl-1-(oxolan-2-yl)but-3-en-2-amine
CID 79190167
[1-(2-Methoxyethoxy)-6-methylhept-6-en-3-yl]hydrazine
CID 102929733
[1-(2-Methoxyethoxy)-5-methylideneheptan-3-yl]hydrazine
CID 102929776
2-Methyl-5-(oxolan-2-yl)pent-1-en-3-amine
CID 105005322
[1-(3,4-dihydro-2H-pyran-5-yl)-2-(oxolan-2-yl)ethyl]hydrazine
CID 105198495
1-(Oxolan-2-yl)hept-6-en-2-ylhydrazine
CID 105198502
1-(Oxolan-2-yl)but-3-en-2-ylhydrazine
CID 105198505
[5-Methyl-1-(oxolan-2-yl)hex-5-en-2-yl]hydrazine
CID 105198591
1-(Oxolan-2-yl)hex-5-en-2-ylhydrazine
CID 105198607
1-(Oxolan-2-yl)pent-4-en-2-ylhydrazine
CID 105198667

Frequently Asked Questions

What is the IUPAC name of [3-methyl-1-(oxolan-2-yl)but-3-en-2-yl]hydrazine?
The IUPAC name of [3-methyl-1-(oxolan-2-yl)but-3-en-2-yl]hydrazine (CID 105198744) is [3-methyl-1-(oxolan-2-yl)but-3-en-2-yl]hydrazine.
What is the SMILES notation for [3-methyl-1-(oxolan-2-yl)but-3-en-2-yl]hydrazine?
The canonical SMILES for [3-methyl-1-(oxolan-2-yl)but-3-en-2-yl]hydrazine is C=C(C)C(CC1CCCO1)NN.
What is the InChIKey of [3-methyl-1-(oxolan-2-yl)but-3-en-2-yl]hydrazine?
The InChIKey is NZJMXFZMXHKZGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O/c1-7(2)9(11-10)6-8-4-3-5-12-8/h8-9,11H,1,3-6,10H2,2H3.
What are the key properties of [3-methyl-1-(oxolan-2-yl)but-3-en-2-yl]hydrazine?
[3-methyl-1-(oxolan-2-yl)but-3-en-2-yl]hydrazine has a molecular weight of 170.26 g/mol, XLogP of 0.96, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-methyl-1-(oxolan-2-yl)but-3-en-2-yl]hydrazine is sourced from PubChem (CID 105198744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).