[4-methyl-4-(2-methylprop-1-enyl)octan-2-yl]hydrazine

C13H28N2 — CID 91547859

IUPAC[4-methyl-4-(2-methylprop-1-enyl)octan-2-yl]hydrazine
SMILESCCCCC(C)(C=C(C)C)CC(C)NN
InChIInChI=1S/C13H28N2/c1-6-7-8-13(5,9-11(2)3)10-12(4)15-14/h9,12,15H,6-8,10,14H2,1-5H3
InChIKeyLPIHPIIQJVHIBM-UHFFFAOYSA-N
MW212.38 g/mol
LogP3.39
Rot. Bonds7

About [4-methyl-4-(2-methylprop-1-enyl)octan-2-yl]hydrazine

[4-methyl-4-(2-methylprop-1-enyl)octan-2-yl]hydrazine (PubChem CID 91547859) has the molecular formula C13H28N2 and a molecular weight of 212.38 g/mol. Its IUPAC name is [4-methyl-4-(2-methylprop-1-enyl)octan-2-yl]hydrazine.

Molecular Properties

Compound Name[4-methyl-4-(2-methylprop-1-enyl)octan-2-yl]hydrazine
PubChem CID91547859
Molecular FormulaC13H28N2
Molecular Weight212.38 g/mol
Exact Mass212.23
IUPAC Name[4-methyl-4-(2-methylprop-1-enyl)octan-2-yl]hydrazine
SMILESCCCCC(C)(C=C(C)C)CC(C)NN
InChIInChI=1S/C13H28N2/c1-6-7-8-13(5,9-11(2)3)10-12(4)15-14/h9,12,15H,6-8,10,14H2,1-5H3
InChIKeyLPIHPIIQJVHIBM-UHFFFAOYSA-N
XLogP3.39
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.38
LogP ≤ 53.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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

[2,4-Dimethyl-3-(2-methylprop-1-enyl)cyclobutyl]hydrazine
CID 67559784
2,2,4-Trimethylcyclohept-4-en-1-amine
CID 123414620
4,4-Dimethylnon-1-en-5-ylhydrazine
CID 140058646
1-[1-(Cyclopropen-1-yl)-2-(3,3-dimethylcyclohexyl)ethyl]-2-methylhydrazine
CID 142227460
1-[1-(Cyclopenten-1-yl)propan-2-yl]-2-(1-cyclopentylpropyl)hydrazine
CID 142947644
1-methyl-2-[(E)-3,5,5,7,7-pentamethyloct-2-en-4-yl]hydrazine
CID 143962805
(3-Butyl-4-methylideneheptan-2-yl)hydrazine
CID 146181027
[(Z)-3-cyclohexyl-4-(3-methylcyclobutyl)but-3-en-2-yl]hydrazine
CID 146400297
18,18-Diethylicos-9-enylhydrazine
CID 154160917
[(Z)-2,2-dimethylnon-5-en-4-yl]hydrazine
CID 155297338
[(3Z,4R)-3-ethylidene-4-methylhexan-2-yl]hydrazine
CID 156227056
(E,2R)-3-(1-hydrazinyl-3-methylbut-3-enyl)oct-6-en-2-amine
CID 163698402

Frequently Asked Questions

What is the IUPAC name of [4-methyl-4-(2-methylprop-1-enyl)octan-2-yl]hydrazine?
The IUPAC name of [4-methyl-4-(2-methylprop-1-enyl)octan-2-yl]hydrazine (CID 91547859) is [4-methyl-4-(2-methylprop-1-enyl)octan-2-yl]hydrazine.
What is the SMILES notation for [4-methyl-4-(2-methylprop-1-enyl)octan-2-yl]hydrazine?
The canonical SMILES for [4-methyl-4-(2-methylprop-1-enyl)octan-2-yl]hydrazine is CCCCC(C)(C=C(C)C)CC(C)NN.
What is the InChIKey of [4-methyl-4-(2-methylprop-1-enyl)octan-2-yl]hydrazine?
The InChIKey is LPIHPIIQJVHIBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2/c1-6-7-8-13(5,9-11(2)3)10-12(4)15-14/h9,12,15H,6-8,10,14H2,1-5H3.
What are the key properties of [4-methyl-4-(2-methylprop-1-enyl)octan-2-yl]hydrazine?
[4-methyl-4-(2-methylprop-1-enyl)octan-2-yl]hydrazine has a molecular weight of 212.38 g/mol, XLogP of 3.39, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-methyl-4-(2-methylprop-1-enyl)octan-2-yl]hydrazine is sourced from PubChem (CID 91547859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).