(2-methylcyclohepta-1,3,6-trien-1-yl)methylhydrazine

C9H14N2 — CID 134457925

IUPAC(2-methylcyclohepta-1,3,6-trien-1-yl)methylhydrazine
SMILESCC1=C(CNN)C=CCC=C1
InChIInChI=1S/C9H14N2/c1-8-5-3-2-4-6-9(8)7-11-10/h3-6,11H,2,7,10H2,1H3
InChIKeyZOHHCWKLPHGXPB-UHFFFAOYSA-N
MW150.22 g/mol
LogP1.28
Rot. Bonds2

About (2-methylcyclohepta-1,3,6-trien-1-yl)methylhydrazine

(2-methylcyclohepta-1,3,6-trien-1-yl)methylhydrazine (PubChem CID 134457925) has the molecular formula C9H14N2 and a molecular weight of 150.22 g/mol. Its IUPAC name is (2-methylcyclohepta-1,3,6-trien-1-yl)methylhydrazine.

Molecular Properties

Compound Name(2-methylcyclohepta-1,3,6-trien-1-yl)methylhydrazine
PubChem CID134457925
Molecular FormulaC9H14N2
Molecular Weight150.22 g/mol
Exact Mass150.12
IUPAC Name(2-methylcyclohepta-1,3,6-trien-1-yl)methylhydrazine
SMILESCC1=C(CNN)C=CCC=C1
InChIInChI=1S/C9H14N2/c1-8-5-3-2-4-6-9(8)7-11-10/h3-6,11H,2,7,10H2,1H3
InChIKeyZOHHCWKLPHGXPB-UHFFFAOYSA-N
XLogP1.28
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.22
LogP ≤ 51.28
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'}

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Frequently Asked Questions

What is the IUPAC name of (2-methylcyclohepta-1,3,6-trien-1-yl)methylhydrazine?
The IUPAC name of (2-methylcyclohepta-1,3,6-trien-1-yl)methylhydrazine (CID 134457925) is (2-methylcyclohepta-1,3,6-trien-1-yl)methylhydrazine.
What is the SMILES notation for (2-methylcyclohepta-1,3,6-trien-1-yl)methylhydrazine?
The canonical SMILES for (2-methylcyclohepta-1,3,6-trien-1-yl)methylhydrazine is CC1=C(CNN)C=CCC=C1.
What is the InChIKey of (2-methylcyclohepta-1,3,6-trien-1-yl)methylhydrazine?
The InChIKey is ZOHHCWKLPHGXPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2/c1-8-5-3-2-4-6-9(8)7-11-10/h3-6,11H,2,7,10H2,1H3.
What are the key properties of (2-methylcyclohepta-1,3,6-trien-1-yl)methylhydrazine?
(2-methylcyclohepta-1,3,6-trien-1-yl)methylhydrazine has a molecular weight of 150.22 g/mol, XLogP of 1.28, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylcyclohepta-1,3,6-trien-1-yl)methylhydrazine is sourced from PubChem (CID 134457925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).