1-cyclohexa-1,3-dien-1-yl-1-methylhydrazine

C7H12N2 — CID 89377633

IUPAC1-cyclohexa-1,3-dien-1-yl-1-methylhydrazine
SMILESCN(N)C1=CC=CCC1
InChIInChI=1S/C7H12N2/c1-9(8)7-5-3-2-4-6-7/h2-3,5H,4,6,8H2,1H3
InChIKeyAYEVVOPNAHYDBU-UHFFFAOYSA-N
MW124.19 g/mol
LogP1.03
Rot. Bonds1

About 1-cyclohexa-1,3-dien-1-yl-1-methylhydrazine

1-cyclohexa-1,3-dien-1-yl-1-methylhydrazine (PubChem CID 89377633) has the molecular formula C7H12N2 and a molecular weight of 124.19 g/mol. Its IUPAC name is 1-cyclohexa-1,3-dien-1-yl-1-methylhydrazine.

Molecular Properties

Compound Name1-cyclohexa-1,3-dien-1-yl-1-methylhydrazine
PubChem CID89377633
Molecular FormulaC7H12N2
Molecular Weight124.19 g/mol
Exact Mass124.10
IUPAC Name1-cyclohexa-1,3-dien-1-yl-1-methylhydrazine
SMILESCN(N)C1=CC=CCC1
InChIInChI=1S/C7H12N2/c1-9(8)7-5-3-2-4-6-7/h2-3,5H,4,6,8H2,1H3
InChIKeyAYEVVOPNAHYDBU-UHFFFAOYSA-N
XLogP1.03
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.19
LogP ≤ 51.03
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'}

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Frequently Asked Questions

What is the IUPAC name of 1-cyclohexa-1,3-dien-1-yl-1-methylhydrazine?
The IUPAC name of 1-cyclohexa-1,3-dien-1-yl-1-methylhydrazine (CID 89377633) is 1-cyclohexa-1,3-dien-1-yl-1-methylhydrazine.
What is the SMILES notation for 1-cyclohexa-1,3-dien-1-yl-1-methylhydrazine?
The canonical SMILES for 1-cyclohexa-1,3-dien-1-yl-1-methylhydrazine is CN(N)C1=CC=CCC1.
What is the InChIKey of 1-cyclohexa-1,3-dien-1-yl-1-methylhydrazine?
The InChIKey is AYEVVOPNAHYDBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2/c1-9(8)7-5-3-2-4-6-7/h2-3,5H,4,6,8H2,1H3.
What are the key properties of 1-cyclohexa-1,3-dien-1-yl-1-methylhydrazine?
1-cyclohexa-1,3-dien-1-yl-1-methylhydrazine has a molecular weight of 124.19 g/mol, XLogP of 1.03, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexa-1,3-dien-1-yl-1-methylhydrazine is sourced from PubChem (CID 89377633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).