1-[(2E,4Z)-hepta-2,4-dien-3-yl]-1-(3-methylbut-2-en-2-yl)hydrazine

C12H22N2 — CID 143110869

IUPAC1-[(2E,4Z)-hepta-2,4-dien-3-yl]-1-(3-methylbut-2-en-2-yl)hydrazine
SMILESC/C=C(\C=C/CC)N(N)C(C)=C(C)C
InChIInChI=1S/C12H22N2/c1-6-8-9-12(7-2)14(13)11(5)10(3)4/h7-9H,6,13H2,1-5H3/b9-8-,12-7+
InChIKeyYPMQMOUFOZBKTJ-ZHCAKQDLSA-N
MW194.32 g/mol
LogP3.35
Rot. Bonds4

About 1-[(2E,4Z)-hepta-2,4-dien-3-yl]-1-(3-methylbut-2-en-2-yl)hydrazine

1-[(2E,4Z)-hepta-2,4-dien-3-yl]-1-(3-methylbut-2-en-2-yl)hydrazine (PubChem CID 143110869) has the molecular formula C12H22N2 and a molecular weight of 194.32 g/mol. Its IUPAC name is 1-[(2E,4Z)-hepta-2,4-dien-3-yl]-1-(3-methylbut-2-en-2-yl)hydrazine.

Molecular Properties

Compound Name1-[(2E,4Z)-hepta-2,4-dien-3-yl]-1-(3-methylbut-2-en-2-yl)hydrazine
PubChem CID143110869
Molecular FormulaC12H22N2
Molecular Weight194.32 g/mol
Exact Mass194.18
IUPAC Name1-[(2E,4Z)-hepta-2,4-dien-3-yl]-1-(3-methylbut-2-en-2-yl)hydrazine
SMILESC/C=C(\C=C/CC)N(N)C(C)=C(C)C
InChIInChI=1S/C12H22N2/c1-6-8-9-12(7-2)14(13)11(5)10(3)4/h7-9H,6,13H2,1-5H3/b9-8-,12-7+
InChIKeyYPMQMOUFOZBKTJ-ZHCAKQDLSA-N
XLogP3.35
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.32
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Related Compounds

1-(4-Fluorocyclohepta-1,3,6-trien-1-yl)-1-(3-methylhexa-2,4-dien-2-yl)hydrazine
CID 123829658
1-Methyl-1-(4-methylbenzene-5-id-1-yl)hydrazine;yttrium
CID 58512384
6-methyl-5-prop-2-enyl-2H-pyridin-1-amine
CID 70507575
[(3E,5Z)-2-methylhepta-1,3,5-trien-3-yl]diazene
CID 89278503
1-methyl-1-[(Z)-4-methylidenehex-2-en-2-yl]hydrazine
CID 89351732
3,6-Dimethyl-2-methylidenepyridin-1-amine
CID 123167586
[(4Z)-4-ethylidene-2-methylhepta-2,5-dien-3-yl]diazene
CID 123685184
1-[(3E,5Z)-5,7-dimethylocta-3,5-dien-4-yl]-1-methylhydrazine
CID 126629500
1-methyl-1-[(3E,5Z)-7-methylocta-3,5,7-trien-4-yl]hydrazine
CID 129065984
[(4Z,6Z,8Z)-7-methyldeca-4,6,8-trien-5-yl]hydrazine
CID 132050238
N-amino-N-[(3E,4Z)-3-ethylidenehexa-1,4-dien-2-yl]thiohydroxylamine
CID 134424836
[(2Z,4E)-3-methylhepta-2,4-dien-4-yl]hydrazine
CID 134448934

Frequently Asked Questions

What is the IUPAC name of 1-[(2E,4Z)-hepta-2,4-dien-3-yl]-1-(3-methylbut-2-en-2-yl)hydrazine?
The IUPAC name of 1-[(2E,4Z)-hepta-2,4-dien-3-yl]-1-(3-methylbut-2-en-2-yl)hydrazine (CID 143110869) is 1-[(2E,4Z)-hepta-2,4-dien-3-yl]-1-(3-methylbut-2-en-2-yl)hydrazine.
What is the SMILES notation for 1-[(2E,4Z)-hepta-2,4-dien-3-yl]-1-(3-methylbut-2-en-2-yl)hydrazine?
The canonical SMILES for 1-[(2E,4Z)-hepta-2,4-dien-3-yl]-1-(3-methylbut-2-en-2-yl)hydrazine is C/C=C(\C=C/CC)N(N)C(C)=C(C)C.
What is the InChIKey of 1-[(2E,4Z)-hepta-2,4-dien-3-yl]-1-(3-methylbut-2-en-2-yl)hydrazine?
The InChIKey is YPMQMOUFOZBKTJ-ZHCAKQDLSA-N. The full InChI is InChI=1S/C12H22N2/c1-6-8-9-12(7-2)14(13)11(5)10(3)4/h7-9H,6,13H2,1-5H3/b9-8-,12-7+.
What are the key properties of 1-[(2E,4Z)-hepta-2,4-dien-3-yl]-1-(3-methylbut-2-en-2-yl)hydrazine?
1-[(2E,4Z)-hepta-2,4-dien-3-yl]-1-(3-methylbut-2-en-2-yl)hydrazine has a molecular weight of 194.32 g/mol, XLogP of 3.35, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2E,4Z)-hepta-2,4-dien-3-yl]-1-(3-methylbut-2-en-2-yl)hydrazine is sourced from PubChem (CID 143110869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).