2-bicyclo[2.2.1]heptanyl-(2-methoxy-2-bicyclo[2.2.1]heptanyl)diazene

C15H24N2O — CID 21387271

IUPAC2-bicyclo[2.2.1]heptanyl-(2-methoxy-2-bicyclo[2.2.1]heptanyl)diazene
SMILESCOC1(/N=N/C2CC3CCC2C3)CC2CCC1C2
InChIInChI=1S/C15H24N2O/c1-18-15(9-11-3-5-13(15)7-11)17-16-14-8-10-2-4-12(14)6-10/h10-14H,2-9H2,1H3/b17-16+
InChIKeyUAVPDKAJDFALPG-WUKNDPDISA-N
MW248.37 g/mol
LogP3.79
Rot. Bonds3

About 2-bicyclo[2.2.1]heptanyl-(2-methoxy-2-bicyclo[2.2.1]heptanyl)diazene

2-bicyclo[2.2.1]heptanyl-(2-methoxy-2-bicyclo[2.2.1]heptanyl)diazene (PubChem CID 21387271) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 2-bicyclo[2.2.1]heptanyl-(2-methoxy-2-bicyclo[2.2.1]heptanyl)diazene.

Molecular Properties

Compound Name2-bicyclo[2.2.1]heptanyl-(2-methoxy-2-bicyclo[2.2.1]heptanyl)diazene
PubChem CID21387271
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name2-bicyclo[2.2.1]heptanyl-(2-methoxy-2-bicyclo[2.2.1]heptanyl)diazene
SMILESCOC1(/N=N/C2CC3CCC2C3)CC2CCC1C2
InChIInChI=1S/C15H24N2O/c1-18-15(9-11-3-5-13(15)7-11)17-16-14-8-10-2-4-12(14)6-10/h10-14H,2-9H2,1H3/b17-16+
InChIKeyUAVPDKAJDFALPG-WUKNDPDISA-N
XLogP3.79
TPSA33.95 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 53.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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

2-bicyclo[2.2.1]heptanyl-(2-chloro-2-bicyclo[2.2.1]heptanyl)diazene
CID 21387404
2-(2-bicyclo[2.2.1]heptanylmethyl)-2-methylbicyclo[2.2.1]heptane
CID 19890420
[(2R)-2-methyl-2-bicyclo[2.2.1]heptanyl] bicyclo[2.2.1]heptane-2-carboxylate
CID 134285849
[2-(2-bicyclo[2.2.1]heptanylmethyl)-2-bicyclo[2.2.1]heptanyl]methanol
CID 79550553
(1S,4R)-2-isothiocyanatobicyclo[2.2.1]heptane
CID 56845501
(1S,2S,4R)-2-isothiocyanatobicyclo[2.2.1]heptane
CID 11869712
[(1S,2R,4R)-2-bicyclo[2.2.1]heptanyl]-dimethoxyphosphane
CID 131858461
(1S,4R)-2-methylbicyclo[2.2.1]heptan-2-ol
CID 134981260
[(1R,2R,4S)-2-ethyl-2-bicyclo[2.2.1]heptanyl] (1R,4S)-bicyclo[2.2.1]heptane-2-carboxylate
CID 91342821
spiro[bicyclo[2.2.1]heptane-2,1'-cyclobutane]
CID 22273219
(1S,2S,3R,6S,8S)-2-methoxytricyclo[4.3.1.13,8]undecane
CID 10329939
(1S,2S,4R)-2-methylbicyclo[2.2.1]heptan-2-amine
CID 131148084

Frequently Asked Questions

What is the IUPAC name of 2-bicyclo[2.2.1]heptanyl-(2-methoxy-2-bicyclo[2.2.1]heptanyl)diazene?
The IUPAC name of 2-bicyclo[2.2.1]heptanyl-(2-methoxy-2-bicyclo[2.2.1]heptanyl)diazene (CID 21387271) is 2-bicyclo[2.2.1]heptanyl-(2-methoxy-2-bicyclo[2.2.1]heptanyl)diazene.
What is the SMILES notation for 2-bicyclo[2.2.1]heptanyl-(2-methoxy-2-bicyclo[2.2.1]heptanyl)diazene?
The canonical SMILES for 2-bicyclo[2.2.1]heptanyl-(2-methoxy-2-bicyclo[2.2.1]heptanyl)diazene is COC1(/N=N/C2CC3CCC2C3)CC2CCC1C2.
What is the InChIKey of 2-bicyclo[2.2.1]heptanyl-(2-methoxy-2-bicyclo[2.2.1]heptanyl)diazene?
The InChIKey is UAVPDKAJDFALPG-WUKNDPDISA-N. The full InChI is InChI=1S/C15H24N2O/c1-18-15(9-11-3-5-13(15)7-11)17-16-14-8-10-2-4-12(14)6-10/h10-14H,2-9H2,1H3/b17-16+.
What are the key properties of 2-bicyclo[2.2.1]heptanyl-(2-methoxy-2-bicyclo[2.2.1]heptanyl)diazene?
2-bicyclo[2.2.1]heptanyl-(2-methoxy-2-bicyclo[2.2.1]heptanyl)diazene has a molecular weight of 248.37 g/mol, XLogP of 3.79, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bicyclo[2.2.1]heptanyl-(2-methoxy-2-bicyclo[2.2.1]heptanyl)diazene is sourced from PubChem (CID 21387271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).