2-ethyl-1-methyl-1-[(2E)-octa-2,7-dienyl]hydrazine

C11H22N2 — CID 87095667

IUPAC2-ethyl-1-methyl-1-[(2E)-octa-2,7-dienyl]hydrazine
SMILESC=CCCC/C=C/CN(C)NCC
InChIInChI=1S/C11H22N2/c1-4-6-7-8-9-10-11-13(3)12-5-2/h4,9-10,12H,1,5-8,11H2,2-3H3/b10-9+
InChIKeyXUDRNXGZZFFFIO-MDZDMXLPSA-N
MW182.31 g/mol
LogP2.36
Rot. Bonds8

About 2-ethyl-1-methyl-1-[(2E)-octa-2,7-dienyl]hydrazine

2-ethyl-1-methyl-1-[(2E)-octa-2,7-dienyl]hydrazine (PubChem CID 87095667) has the molecular formula C11H22N2 and a molecular weight of 182.31 g/mol. Its IUPAC name is 2-ethyl-1-methyl-1-[(2E)-octa-2,7-dienyl]hydrazine.

Molecular Properties

Compound Name2-ethyl-1-methyl-1-[(2E)-octa-2,7-dienyl]hydrazine
PubChem CID87095667
Molecular FormulaC11H22N2
Molecular Weight182.31 g/mol
Exact Mass182.18
IUPAC Name2-ethyl-1-methyl-1-[(2E)-octa-2,7-dienyl]hydrazine
SMILESC=CCCC/C=C/CN(C)NCC
InChIInChI=1S/C11H22N2/c1-4-6-7-8-9-10-11-13(3)12-5-2/h4,9-10,12H,1,5-8,11H2,2-3H3/b10-9+
InChIKeyXUDRNXGZZFFFIO-MDZDMXLPSA-N
XLogP2.36
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.31
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', '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-(5-Hexen-1-yl)-1,1-dimethylhydrazine
CID 57552151
2-ethyl-1-[(E)-2-fluoropent-2-enyl]-1-methylhydrazine
CID 148394970
N,N-dimethyl-N'-(octa-2,7-dien-1-yl)hydrazine
CID 129739724
N,N'-bis(octa-2,7-dien-1-yl)hydrazine
CID 129740184
N-ethyl-N,N'-bis(octa-2,7-dien-1-yl)hydrazine
CID 129740242
N-(2,7-octadienyl)-pyrazoline
CID 129811290
N-2,7-octadienylhydrazine
CID 129811843
CID 59855727
CID 59855727
2-Methyl-1,3,6,7-tetrahydrodiazepine
CID 70527177
2-ethyl-1-methyl-1-[(4E,6E)-octa-4,6-dienyl]hydrazine
CID 87095586
2-ethyl-1-methyl-1-[(3E)-octa-3,7-dienyl]hydrazine
CID 87095603
2-ethyl-1-methyl-1-[(3E,5E)-octa-3,5-dienyl]hydrazine
CID 87095637

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-1-methyl-1-[(2E)-octa-2,7-dienyl]hydrazine?
The IUPAC name of 2-ethyl-1-methyl-1-[(2E)-octa-2,7-dienyl]hydrazine (CID 87095667) is 2-ethyl-1-methyl-1-[(2E)-octa-2,7-dienyl]hydrazine.
What is the SMILES notation for 2-ethyl-1-methyl-1-[(2E)-octa-2,7-dienyl]hydrazine?
The canonical SMILES for 2-ethyl-1-methyl-1-[(2E)-octa-2,7-dienyl]hydrazine is C=CCCC/C=C/CN(C)NCC.
What is the InChIKey of 2-ethyl-1-methyl-1-[(2E)-octa-2,7-dienyl]hydrazine?
The InChIKey is XUDRNXGZZFFFIO-MDZDMXLPSA-N. The full InChI is InChI=1S/C11H22N2/c1-4-6-7-8-9-10-11-13(3)12-5-2/h4,9-10,12H,1,5-8,11H2,2-3H3/b10-9+.
What are the key properties of 2-ethyl-1-methyl-1-[(2E)-octa-2,7-dienyl]hydrazine?
2-ethyl-1-methyl-1-[(2E)-octa-2,7-dienyl]hydrazine has a molecular weight of 182.31 g/mol, XLogP of 2.36, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-1-methyl-1-[(2E)-octa-2,7-dienyl]hydrazine is sourced from PubChem (CID 87095667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).