(E)-(4,4,7,7-tetramethylcycloocta-2,5-dien-1-ylidene)hydrazine

C12H20N2 — CID 123583253

IUPAC(E)-(4,4,7,7-tetramethylcycloocta-2,5-dien-1-ylidene)hydrazine
SMILESCC1(C)C=C/C(=N/N)CC(C)(C)C=C1
InChIInChI=1S/C12H20N2/c1-11(2)6-5-10(14-13)9-12(3,4)8-7-11/h5-8H,9,13H2,1-4H3/b6-5?,8-7?,14-10-
InChIKeyVSXOFGLCYHIMPF-IZPBEGCPSA-N
MW192.31 g/mol
LogP2.87
Rot. Bonds

About (E)-(4,4,7,7-tetramethylcycloocta-2,5-dien-1-ylidene)hydrazine

(E)-(4,4,7,7-tetramethylcycloocta-2,5-dien-1-ylidene)hydrazine (PubChem CID 123583253) has the molecular formula C12H20N2 and a molecular weight of 192.31 g/mol. Its IUPAC name is (E)-(4,4,7,7-tetramethylcycloocta-2,5-dien-1-ylidene)hydrazine.

Molecular Properties

Compound Name(E)-(4,4,7,7-tetramethylcycloocta-2,5-dien-1-ylidene)hydrazine
PubChem CID123583253
Molecular FormulaC12H20N2
Molecular Weight192.31 g/mol
Exact Mass192.16
IUPAC Name(E)-(4,4,7,7-tetramethylcycloocta-2,5-dien-1-ylidene)hydrazine
SMILESCC1(C)C=C/C(=N/N)CC(C)(C)C=C1
InChIInChI=1S/C12H20N2/c1-11(2)6-5-10(14-13)9-12(3,4)8-7-11/h5-8H,9,13H2,1-4H3/b6-5?,8-7?,14-10-
InChIKeyVSXOFGLCYHIMPF-IZPBEGCPSA-N
XLogP2.87
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.31
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', '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

(E)-[(Z)-2,2-dimethylhex-4-en-3-ylidene]hydrazine
CID 57942592
2,2,5,6,6-Pentamethylhept-4-en-3-ylidenehydrazine
CID 87771116
(6-Imino-1,4,4-trimethylcycloocta-2,7-dien-1-yl)methanamine
CID 90898811
(2Z)-4,4,7,7-tetramethylcycloocta-2,5-dien-1-imine
CID 91254101
4,4,7,7-Tetramethylcycloocta-2,5-dien-1-imine
CID 123219952
(E)-(6,6-dimethylcyclohepta-2,4-dien-1-ylidene)hydrazine
CID 123784868
(E)-[(E)-2,2,5,6,6-pentamethylhept-4-en-3-ylidene]hydrazine
CID 134444351
(Z)-6,6-dimethylhept-3-ene-2,5-diimine
CID 134570447
(E)-[(4Z)-2,2-dimethylhepta-4,6-dien-3-ylidene]hydrazine
CID 137437147
(Z)-[(Z)-6-ethyl-2,7,7-trimethyloct-4-en-3-ylidene]hydrazine
CID 139319189
(Z)-[(Z)-3-tert-butylpent-3-en-2-ylidene]hydrazine
CID 155153353
(6E,9Z)-5-ethenyl-4-imino-3-(iodohydrazinylidene)undeca-1,6,9-triene
CID 163892384

Frequently Asked Questions

What is the IUPAC name of (E)-(4,4,7,7-tetramethylcycloocta-2,5-dien-1-ylidene)hydrazine?
The IUPAC name of (E)-(4,4,7,7-tetramethylcycloocta-2,5-dien-1-ylidene)hydrazine (CID 123583253) is (E)-(4,4,7,7-tetramethylcycloocta-2,5-dien-1-ylidene)hydrazine.
What is the SMILES notation for (E)-(4,4,7,7-tetramethylcycloocta-2,5-dien-1-ylidene)hydrazine?
The canonical SMILES for (E)-(4,4,7,7-tetramethylcycloocta-2,5-dien-1-ylidene)hydrazine is CC1(C)C=C/C(=N/N)CC(C)(C)C=C1.
What is the InChIKey of (E)-(4,4,7,7-tetramethylcycloocta-2,5-dien-1-ylidene)hydrazine?
The InChIKey is VSXOFGLCYHIMPF-IZPBEGCPSA-N. The full InChI is InChI=1S/C12H20N2/c1-11(2)6-5-10(14-13)9-12(3,4)8-7-11/h5-8H,9,13H2,1-4H3/b6-5?,8-7?,14-10-.
What are the key properties of (E)-(4,4,7,7-tetramethylcycloocta-2,5-dien-1-ylidene)hydrazine?
(E)-(4,4,7,7-tetramethylcycloocta-2,5-dien-1-ylidene)hydrazine has a molecular weight of 192.31 g/mol, XLogP of 2.87, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-(4,4,7,7-tetramethylcycloocta-2,5-dien-1-ylidene)hydrazine is sourced from PubChem (CID 123583253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).