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

C9H18N2O — CID 105229224

IUPAC[3-methyl-1-(oxolan-2-yl)but-2-enyl]hydrazine
SMILESCC(C)=CC(NN)C1CCCO1
InChIInChI=1S/C9H18N2O/c1-7(2)6-8(11-10)9-4-3-5-12-9/h6,8-9,11H,3-5,10H2,1-2H3
InChIKeyLRDSLKDBWFWNMA-UHFFFAOYSA-N
MW170.26 g/mol
LogP0.96
Rot. Bonds3

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

[3-methyl-1-(oxolan-2-yl)but-2-enyl]hydrazine (PubChem CID 105229224) 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-2-enyl]hydrazine.

Molecular Properties

Compound Name[3-methyl-1-(oxolan-2-yl)but-2-enyl]hydrazine
PubChem CID105229224
Molecular FormulaC9H18N2O
Molecular Weight170.26 g/mol
Exact Mass170.14
IUPAC Name[3-methyl-1-(oxolan-2-yl)but-2-enyl]hydrazine
SMILESCC(C)=CC(NN)C1CCCO1
InChIInChI=1S/C9H18N2O/c1-7(2)6-8(11-10)9-4-3-5-12-9/h6,8-9,11H,3-5,10H2,1-2H3
InChIKeyLRDSLKDBWFWNMA-UHFFFAOYSA-N
XLogP0.96
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
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

(5-Hydrazinyl-4-methoxycyclohexen-1-yl)methanamine
CID 163444875
3-Methyl-1-(oxolan-2-yl)but-2-en-1-amine
CID 79180101
[3,4-dihydro-2H-pyran-6-yl(oxolan-2-yl)methyl]hydrazine
CID 102650003
[3,4-dihydro-2H-pyran-6-yl-(5-methyloxolan-2-yl)methyl]hydrazine
CID 102650257
[3,4-dihydro-2H-pyran-6-yl-(3-methyloxolan-2-yl)methyl]hydrazine
CID 102650325
[2,3-Dihydrofuran-5-yl(oxolan-2-yl)methyl]hydrazine
CID 102654178
1-(2,3-Dihydrofuran-5-yl)pentylhydrazine
CID 102654242
[1-(2,3-Dihydrofuran-5-yl)-2-ethoxypentyl]hydrazine
CID 102654330
[1-(2,3-Dihydrofuran-5-yl)-2-methoxypentyl]hydrazine
CID 102654331
[2,3-Dihydrofuran-5-yl-(5-methyloxolan-2-yl)methyl]hydrazine
CID 102654444
[2,3-Dihydrofuran-5-yl-(3-methyloxolan-2-yl)methyl]hydrazine
CID 102654512
1-(2,3-Dihydrofuran-5-yl)hexylhydrazine
CID 102654577

Frequently Asked Questions

What is the IUPAC name of [3-methyl-1-(oxolan-2-yl)but-2-enyl]hydrazine?
The IUPAC name of [3-methyl-1-(oxolan-2-yl)but-2-enyl]hydrazine (CID 105229224) is [3-methyl-1-(oxolan-2-yl)but-2-enyl]hydrazine.
What is the SMILES notation for [3-methyl-1-(oxolan-2-yl)but-2-enyl]hydrazine?
The canonical SMILES for [3-methyl-1-(oxolan-2-yl)but-2-enyl]hydrazine is CC(C)=CC(NN)C1CCCO1.
What is the InChIKey of [3-methyl-1-(oxolan-2-yl)but-2-enyl]hydrazine?
The InChIKey is LRDSLKDBWFWNMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O/c1-7(2)6-8(11-10)9-4-3-5-12-9/h6,8-9,11H,3-5,10H2,1-2H3.
What are the key properties of [3-methyl-1-(oxolan-2-yl)but-2-enyl]hydrazine?
[3-methyl-1-(oxolan-2-yl)but-2-enyl]hydrazine has a molecular weight of 170.26 g/mol, XLogP of 0.96, 3 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-2-enyl]hydrazine is sourced from PubChem (CID 105229224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).