bis(3,4-dimethylcyclohexyl)diazene

C16H30N2 — CID 140801963

IUPACbis(3,4-dimethylcyclohexyl)diazene
SMILESCC1CCC(/N=N/C2CCC(C)C(C)C2)CC1C
InChIInChI=1S/C16H30N2/c1-11-5-7-15(9-13(11)3)17-18-16-8-6-12(2)14(4)10-16/h11-16H,5-10H2,1-4H3/b18-17+
InChIKeyDQVVFGMSUWDYON-ISLYRVAYSA-N
MW250.43 g/mol
LogP5.09
Rot. Bonds2

About bis(3,4-dimethylcyclohexyl)diazene

bis(3,4-dimethylcyclohexyl)diazene (PubChem CID 140801963) has the molecular formula C16H30N2 and a molecular weight of 250.43 g/mol. Its IUPAC name is bis(3,4-dimethylcyclohexyl)diazene.

Molecular Properties

Compound Namebis(3,4-dimethylcyclohexyl)diazene
PubChem CID140801963
Molecular FormulaC16H30N2
Molecular Weight250.43 g/mol
Exact Mass250.24
IUPAC Namebis(3,4-dimethylcyclohexyl)diazene
SMILESCC1CCC(/N=N/C2CCC(C)C(C)C2)CC1C
InChIInChI=1S/C16H30N2/c1-11-5-7-15(9-13(11)3)17-18-16-8-6-12(2)14(4)10-16/h11-16H,5-10H2,1-4H3/b18-17+
InChIKeyDQVVFGMSUWDYON-ISLYRVAYSA-N
XLogP5.09
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500250.43
LogP ≤ 55.09
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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Related Compounds

N'-(3,4-dimethylcyclohexyl)-2-methylpropanimidamide
CID 64749964
1,2,4,7-tetramethylcyclononane
CID 123661715
4-[(1R)-3,4-dimethylcyclohexyl]sulfonyl-1,2-dimethylcyclohexane
CID 166684232
(1R,3R,4S)-3,4-dimethylcyclohexan-1-ol
CID 6994302
4-(3,4-dimethylcyclohexyl)oxy-1,2-dimethylcyclohexane
CID 90160887
1,2-difluoro-4,5-dimethylcycloheptane
CID 143035426
4-(3,4-dimethylcyclohexyl)oxy-1,2-dimethylcyclohexane;ethane
CID 153365262
1,2-dimethylcyclobutane;2-methylpropane
CID 143728444
trans-(2R,4R)-1,2-dimethyl-4-(4-methylcyclohexyl)cyclohexane
CID 59970721
deuterium monohydride;1,2-dimethylcyclopropane
CID 159192336
[(1R,3S)-3,4-dimethylcyclohexyl]methanol
CID 118389064
(3,4-dimethylcyclohexyl)methanol
CID 22708626

Frequently Asked Questions

What is the IUPAC name of bis(3,4-dimethylcyclohexyl)diazene?
The IUPAC name of bis(3,4-dimethylcyclohexyl)diazene (CID 140801963) is bis(3,4-dimethylcyclohexyl)diazene.
What is the SMILES notation for bis(3,4-dimethylcyclohexyl)diazene?
The canonical SMILES for bis(3,4-dimethylcyclohexyl)diazene is CC1CCC(/N=N/C2CCC(C)C(C)C2)CC1C.
What is the InChIKey of bis(3,4-dimethylcyclohexyl)diazene?
The InChIKey is DQVVFGMSUWDYON-ISLYRVAYSA-N. The full InChI is InChI=1S/C16H30N2/c1-11-5-7-15(9-13(11)3)17-18-16-8-6-12(2)14(4)10-16/h11-16H,5-10H2,1-4H3/b18-17+.
What are the key properties of bis(3,4-dimethylcyclohexyl)diazene?
bis(3,4-dimethylcyclohexyl)diazene has a molecular weight of 250.43 g/mol, XLogP of 5.09, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for bis(3,4-dimethylcyclohexyl)diazene is sourced from PubChem (CID 140801963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).