(5-methylcyclohexa-1,3-dien-1-yl)methylhydrazine

C8H14N2 — CID 121291710

IUPAC(5-methylcyclohexa-1,3-dien-1-yl)methylhydrazine
SMILESCC1C=CC=C(CNN)C1
InChIInChI=1S/C8H14N2/c1-7-3-2-4-8(5-7)6-10-9/h2-4,7,10H,5-6,9H2,1H3
InChIKeyXVVGDGHGLTUYKK-UHFFFAOYSA-N
MW138.21 g/mol
LogP0.97
Rot. Bonds2

About (5-methylcyclohexa-1,3-dien-1-yl)methylhydrazine

(5-methylcyclohexa-1,3-dien-1-yl)methylhydrazine (PubChem CID 121291710) has the molecular formula C8H14N2 and a molecular weight of 138.21 g/mol. Its IUPAC name is (5-methylcyclohexa-1,3-dien-1-yl)methylhydrazine.

Molecular Properties

Compound Name(5-methylcyclohexa-1,3-dien-1-yl)methylhydrazine
PubChem CID121291710
Molecular FormulaC8H14N2
Molecular Weight138.21 g/mol
Exact Mass138.12
IUPAC Name(5-methylcyclohexa-1,3-dien-1-yl)methylhydrazine
SMILESCC1C=CC=C(CNN)C1
InChIInChI=1S/C8H14N2/c1-7-3-2-4-8(5-7)6-10-9/h2-4,7,10H,5-6,9H2,1H3
InChIKeyXVVGDGHGLTUYKK-UHFFFAOYSA-N
XLogP0.97
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.21
LogP ≤ 50.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze (5-methylcyclohexa-1,3-dien-1-yl)methylhydrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (5-methylcyclohexa-1,3-dien-1-yl)methylhydrazine?
The IUPAC name of (5-methylcyclohexa-1,3-dien-1-yl)methylhydrazine (CID 121291710) is (5-methylcyclohexa-1,3-dien-1-yl)methylhydrazine.
What is the SMILES notation for (5-methylcyclohexa-1,3-dien-1-yl)methylhydrazine?
The canonical SMILES for (5-methylcyclohexa-1,3-dien-1-yl)methylhydrazine is CC1C=CC=C(CNN)C1.
What is the InChIKey of (5-methylcyclohexa-1,3-dien-1-yl)methylhydrazine?
The InChIKey is XVVGDGHGLTUYKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2/c1-7-3-2-4-8(5-7)6-10-9/h2-4,7,10H,5-6,9H2,1H3.
What are the key properties of (5-methylcyclohexa-1,3-dien-1-yl)methylhydrazine?
(5-methylcyclohexa-1,3-dien-1-yl)methylhydrazine has a molecular weight of 138.21 g/mol, XLogP of 0.97, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methylcyclohexa-1,3-dien-1-yl)methylhydrazine is sourced from PubChem (CID 121291710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).