[(Z)-2,7-dimethyloct-3-en-3-yl]-methyldiazene

C11H22N2 — CID 176934454

IUPAC[(Z)-2,7-dimethyloct-3-en-3-yl]-methyldiazene
SMILESC/N=N/C(=C\CCC(C)C)C(C)C
InChIInChI=1S/C11H22N2/c1-9(2)7-6-8-11(10(3)4)13-12-5/h8-10H,6-7H2,1-5H3/b11-8-,13-12+
InChIKeyCWYVEVVMBQZYSS-STZLXFPOSA-N
MW182.31 g/mol
LogP4.04
Rot. Bonds5

About [(Z)-2,7-dimethyloct-3-en-3-yl]-methyldiazene

[(Z)-2,7-dimethyloct-3-en-3-yl]-methyldiazene (PubChem CID 176934454) has the molecular formula C11H22N2 and a molecular weight of 182.31 g/mol. Its IUPAC name is [(Z)-2,7-dimethyloct-3-en-3-yl]-methyldiazene.

Molecular Properties

Compound Name[(Z)-2,7-dimethyloct-3-en-3-yl]-methyldiazene
PubChem CID176934454
Molecular FormulaC11H22N2
Molecular Weight182.31 g/mol
Exact Mass182.18
IUPAC Name[(Z)-2,7-dimethyloct-3-en-3-yl]-methyldiazene
SMILESC/N=N/C(=C\CCC(C)C)C(C)C
InChIInChI=1S/C11H22N2/c1-9(2)7-6-8-11(10(3)4)13-12-5/h8-10H,6-7H2,1-5H3/b11-8-,13-12+
InChIKeyCWYVEVVMBQZYSS-STZLXFPOSA-N
XLogP4.04
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.31
LogP ≤ 54.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

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Related Compounds

3,5-di(propan-2-yl)-3H-pyrazole
CID 58574928
5-(4-methylpentyl)-3H-pyrazole
CID 89419461
Dimethyl(6-methylhept-2-en-3-ylimino)azanium
CID 91326574
[(E)-8-methylnon-3-en-4-yl]diazene
CID 118074628
But-3-en-2-ylimino-methyl-(6-methylocta-2,7-dien-2-yl)azanium
CID 123507402
Methyl(5-methylhex-1-en-2-yl)diazene
CID 126626156
2-methylpent-1-ene;methyl-[(Z)-pent-2-en-3-yl]diazene
CID 143737800
methyl-[(3Z)-2,5,5-trimethylhepta-3,6-dien-3-yl]diazene
CID 145320881
methyl-[(Z)-2-methyl-5-methylidenehept-3-en-3-yl]diazene
CID 169667913
[(Z)-2,6-dimethyl-5-methylidenehept-3-en-3-yl]-methyldiazene
CID 169667917
butan-2-yl-[(Z)-4-methylpent-2-en-3-yl]diazene
CID 170345029
3,5-bis(2-methylpropyl)-3H-pyrazole
CID 173078604

Frequently Asked Questions

What is the IUPAC name of [(Z)-2,7-dimethyloct-3-en-3-yl]-methyldiazene?
The IUPAC name of [(Z)-2,7-dimethyloct-3-en-3-yl]-methyldiazene (CID 176934454) is [(Z)-2,7-dimethyloct-3-en-3-yl]-methyldiazene.
What is the SMILES notation for [(Z)-2,7-dimethyloct-3-en-3-yl]-methyldiazene?
The canonical SMILES for [(Z)-2,7-dimethyloct-3-en-3-yl]-methyldiazene is C/N=N/C(=C\CCC(C)C)C(C)C.
What is the InChIKey of [(Z)-2,7-dimethyloct-3-en-3-yl]-methyldiazene?
The InChIKey is CWYVEVVMBQZYSS-STZLXFPOSA-N. The full InChI is InChI=1S/C11H22N2/c1-9(2)7-6-8-11(10(3)4)13-12-5/h8-10H,6-7H2,1-5H3/b11-8-,13-12+.
What are the key properties of [(Z)-2,7-dimethyloct-3-en-3-yl]-methyldiazene?
[(Z)-2,7-dimethyloct-3-en-3-yl]-methyldiazene has a molecular weight of 182.31 g/mol, XLogP of 4.04, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z)-2,7-dimethyloct-3-en-3-yl]-methyldiazene is sourced from PubChem (CID 176934454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).