2-cyclobutylethyl(methyl)diazene

C7H14N2 — CID 123370083

IUPAC2-cyclobutylethyl(methyl)diazene
SMILESC/N=N/CCC1CCC1
InChIInChI=1S/C7H14N2/c1-8-9-6-5-7-3-2-4-7/h7H,2-6H2,1H3/b9-8+
InChIKeyRSMBSIMTSQYTKT-CMDGGOBGSA-N
MW126.20 g/mol
LogP2.26
Rot. Bonds3

About 2-cyclobutylethyl(methyl)diazene

2-cyclobutylethyl(methyl)diazene (PubChem CID 123370083) has the molecular formula C7H14N2 and a molecular weight of 126.20 g/mol. Its IUPAC name is 2-cyclobutylethyl(methyl)diazene.

Molecular Properties

Compound Name2-cyclobutylethyl(methyl)diazene
PubChem CID123370083
Molecular FormulaC7H14N2
Molecular Weight126.20 g/mol
Exact Mass126.12
IUPAC Name2-cyclobutylethyl(methyl)diazene
SMILESC/N=N/CCC1CCC1
InChIInChI=1S/C7H14N2/c1-8-9-6-5-7-3-2-4-7/h7H,2-6H2,1H3/b9-8+
InChIKeyRSMBSIMTSQYTKT-CMDGGOBGSA-N
XLogP2.26
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.20
LogP ≤ 52.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

Analyze 2-cyclobutylethyl(methyl)diazene with MolForge

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

Launch Full Analysis

Related Compounds

2-azidoethylcyclobutane
CID 130913828
2-nitrosoethylcyclooctane
CID 129141307
2-nitrosoethylcyclotridecane
CID 138619052
5-cyclobutylpentylcyclobutane
CID 173228999
N'-(2-cyclohexylethyl)ethanimidamide
CID 63173186
hydrazine;propylcyclobutane;hydrochloride
CID 18995287
3-cyclobutylpropylcyclohexane
CID 54165208
4-propylcycloheptan-1-ol
CID 15687798
1-[2-(2-methylcyclopropyl)ethyl]-4-propylcycloheptane
CID 123786912
2-(2-methylcyclopropyl)ethylcyclohexane
CID 91503845
1-(2-cyclobutylethyl)-3-ethylcyclobutane
CID 123886657
propylcyclotetradecane
CID 90991550

Frequently Asked Questions

What is the IUPAC name of 2-cyclobutylethyl(methyl)diazene?
The IUPAC name of 2-cyclobutylethyl(methyl)diazene (CID 123370083) is 2-cyclobutylethyl(methyl)diazene.
What is the SMILES notation for 2-cyclobutylethyl(methyl)diazene?
The canonical SMILES for 2-cyclobutylethyl(methyl)diazene is C/N=N/CCC1CCC1.
What is the InChIKey of 2-cyclobutylethyl(methyl)diazene?
The InChIKey is RSMBSIMTSQYTKT-CMDGGOBGSA-N. The full InChI is InChI=1S/C7H14N2/c1-8-9-6-5-7-3-2-4-7/h7H,2-6H2,1H3/b9-8+.
What are the key properties of 2-cyclobutylethyl(methyl)diazene?
2-cyclobutylethyl(methyl)diazene has a molecular weight of 126.20 g/mol, XLogP of 2.26, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclobutylethyl(methyl)diazene is sourced from PubChem (CID 123370083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).