[4-methyl-1-(2-methyloxan-2-yl)pent-4-enyl]hydrazine

C12H24N2O — CID 105256110

IUPAC[4-methyl-1-(2-methyloxan-2-yl)pent-4-enyl]hydrazine
SMILESC=C(C)CCC(NN)C1(C)CCCCO1
InChIInChI=1S/C12H24N2O/c1-10(2)6-7-11(14-13)12(3)8-4-5-9-15-12/h11,14H,1,4-9,13H2,2-3H3
InChIKeyIYHXSEYHYHWEAI-UHFFFAOYSA-N
MW212.34 g/mol
LogP2.13
Rot. Bonds5

About [4-methyl-1-(2-methyloxan-2-yl)pent-4-enyl]hydrazine

[4-methyl-1-(2-methyloxan-2-yl)pent-4-enyl]hydrazine (PubChem CID 105256110) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is [4-methyl-1-(2-methyloxan-2-yl)pent-4-enyl]hydrazine.

Molecular Properties

Compound Name[4-methyl-1-(2-methyloxan-2-yl)pent-4-enyl]hydrazine
PubChem CID105256110
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name[4-methyl-1-(2-methyloxan-2-yl)pent-4-enyl]hydrazine
SMILESC=C(C)CCC(NN)C1(C)CCCCO1
InChIInChI=1S/C12H24N2O/c1-10(2)6-7-11(14-13)12(3)8-4-5-9-15-12/h11,14H,1,4-9,13H2,2-3H3
InChIKeyIYHXSEYHYHWEAI-UHFFFAOYSA-N
XLogP2.13
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 52.13
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 [4-methyl-1-(2-methyloxan-2-yl)pent-4-enyl]hydrazine?
The IUPAC name of [4-methyl-1-(2-methyloxan-2-yl)pent-4-enyl]hydrazine (CID 105256110) is [4-methyl-1-(2-methyloxan-2-yl)pent-4-enyl]hydrazine.
What is the SMILES notation for [4-methyl-1-(2-methyloxan-2-yl)pent-4-enyl]hydrazine?
The canonical SMILES for [4-methyl-1-(2-methyloxan-2-yl)pent-4-enyl]hydrazine is C=C(C)CCC(NN)C1(C)CCCCO1.
What is the InChIKey of [4-methyl-1-(2-methyloxan-2-yl)pent-4-enyl]hydrazine?
The InChIKey is IYHXSEYHYHWEAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-10(2)6-7-11(14-13)12(3)8-4-5-9-15-12/h11,14H,1,4-9,13H2,2-3H3.
What are the key properties of [4-methyl-1-(2-methyloxan-2-yl)pent-4-enyl]hydrazine?
[4-methyl-1-(2-methyloxan-2-yl)pent-4-enyl]hydrazine has a molecular weight of 212.34 g/mol, XLogP of 2.13, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-methyl-1-(2-methyloxan-2-yl)pent-4-enyl]hydrazine is sourced from PubChem (CID 105256110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).