(E)-(6,6-dimethylcyclohepta-2,4-dien-1-ylidene)hydrazine

C9H14N2 — CID 123784868

IUPAC(E)-(6,6-dimethylcyclohepta-2,4-dien-1-ylidene)hydrazine
SMILESCC1(C)C=CC=C/C(=N/N)C1
InChIInChI=1S/C9H14N2/c1-9(2)6-4-3-5-8(7-9)11-10/h3-6H,7,10H2,1-2H3/b11-8-
InChIKeyMTFAGUHYORPLNS-FLIBITNWSA-N
MW150.22 g/mol
LogP1.84
Rot. Bonds

About (E)-(6,6-dimethylcyclohepta-2,4-dien-1-ylidene)hydrazine

(E)-(6,6-dimethylcyclohepta-2,4-dien-1-ylidene)hydrazine (PubChem CID 123784868) has the molecular formula C9H14N2 and a molecular weight of 150.22 g/mol. Its IUPAC name is (E)-(6,6-dimethylcyclohepta-2,4-dien-1-ylidene)hydrazine.

Molecular Properties

Compound Name(E)-(6,6-dimethylcyclohepta-2,4-dien-1-ylidene)hydrazine
PubChem CID123784868
Molecular FormulaC9H14N2
Molecular Weight150.22 g/mol
Exact Mass150.12
IUPAC Name(E)-(6,6-dimethylcyclohepta-2,4-dien-1-ylidene)hydrazine
SMILESCC1(C)C=CC=C/C(=N/N)C1
InChIInChI=1S/C9H14N2/c1-9(2)6-4-3-5-8(7-9)11-10/h3-6H,7,10H2,1-2H3/b11-8-
InChIKeyMTFAGUHYORPLNS-FLIBITNWSA-N
XLogP1.84
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.22
LogP ≤ 51.84
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': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (E)-(6,6-dimethylcyclohepta-2,4-dien-1-ylidene)hydrazine?
The IUPAC name of (E)-(6,6-dimethylcyclohepta-2,4-dien-1-ylidene)hydrazine (CID 123784868) is (E)-(6,6-dimethylcyclohepta-2,4-dien-1-ylidene)hydrazine.
What is the SMILES notation for (E)-(6,6-dimethylcyclohepta-2,4-dien-1-ylidene)hydrazine?
The canonical SMILES for (E)-(6,6-dimethylcyclohepta-2,4-dien-1-ylidene)hydrazine is CC1(C)C=CC=C/C(=N/N)C1.
What is the InChIKey of (E)-(6,6-dimethylcyclohepta-2,4-dien-1-ylidene)hydrazine?
The InChIKey is MTFAGUHYORPLNS-FLIBITNWSA-N. The full InChI is InChI=1S/C9H14N2/c1-9(2)6-4-3-5-8(7-9)11-10/h3-6H,7,10H2,1-2H3/b11-8-.
What are the key properties of (E)-(6,6-dimethylcyclohepta-2,4-dien-1-ylidene)hydrazine?
(E)-(6,6-dimethylcyclohepta-2,4-dien-1-ylidene)hydrazine has a molecular weight of 150.22 g/mol, XLogP of 1.84, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-(6,6-dimethylcyclohepta-2,4-dien-1-ylidene)hydrazine is sourced from PubChem (CID 123784868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).