bis(2,3-dimethylpentyl)diazene

C14H30N2 — CID 91489079

IUPACbis(2,3-dimethylpentyl)diazene
SMILESCCC(C)C(C)C/N=N/CC(C)C(C)CC
InChIInChI=1S/C14H30N2/c1-7-11(3)13(5)9-15-16-10-14(6)12(4)8-2/h11-14H,7-10H2,1-6H3/b16-15+
InChIKeyBJALKVFHOTUWKP-FOCLMDBBSA-N
MW226.41 g/mol
LogP4.80
Rot. Bonds8

About bis(2,3-dimethylpentyl)diazene

bis(2,3-dimethylpentyl)diazene (PubChem CID 91489079) has the molecular formula C14H30N2 and a molecular weight of 226.41 g/mol. Its IUPAC name is bis(2,3-dimethylpentyl)diazene.

Molecular Properties

Compound Namebis(2,3-dimethylpentyl)diazene
PubChem CID91489079
Molecular FormulaC14H30N2
Molecular Weight226.41 g/mol
Exact Mass226.24
IUPAC Namebis(2,3-dimethylpentyl)diazene
SMILESCCC(C)C(C)C/N=N/CC(C)C(C)CC
InChIInChI=1S/C14H30N2/c1-7-11(3)13(5)9-15-16-10-14(6)12(4)8-2/h11-14H,7-10H2,1-6H3/b16-15+
InChIKeyBJALKVFHOTUWKP-FOCLMDBBSA-N
XLogP4.80
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.41
LogP ≤ 54.80
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'}

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Frequently Asked Questions

What is the IUPAC name of bis(2,3-dimethylpentyl)diazene?
The IUPAC name of bis(2,3-dimethylpentyl)diazene (CID 91489079) is bis(2,3-dimethylpentyl)diazene.
What is the SMILES notation for bis(2,3-dimethylpentyl)diazene?
The canonical SMILES for bis(2,3-dimethylpentyl)diazene is CCC(C)C(C)C/N=N/CC(C)C(C)CC.
What is the InChIKey of bis(2,3-dimethylpentyl)diazene?
The InChIKey is BJALKVFHOTUWKP-FOCLMDBBSA-N. The full InChI is InChI=1S/C14H30N2/c1-7-11(3)13(5)9-15-16-10-14(6)12(4)8-2/h11-14H,7-10H2,1-6H3/b16-15+.
What are the key properties of bis(2,3-dimethylpentyl)diazene?
bis(2,3-dimethylpentyl)diazene has a molecular weight of 226.41 g/mol, XLogP of 4.80, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2,3-dimethylpentyl)diazene is sourced from PubChem (CID 91489079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).