phenyl-[2-(2-phenylpropan-2-yl)phenyl]diazene

C21H20N2 — CID 88596726

IUPACphenyl-[2-(2-phenylpropan-2-yl)phenyl]diazene
SMILESCC(C)(c1ccccc1)c1ccccc1/N=N/c1ccccc1
InChIInChI=1S/C21H20N2/c1-21(2,17-11-5-3-6-12-17)19-15-9-10-16-20(19)23-22-18-13-7-4-8-14-18/h3-16H,1-2H3/b23-22+
InChIKeyKCYQUPUTDHOLGT-GHVJWSGMSA-N
MW300.41 g/mol
LogP6.43
Rot. Bonds4

About phenyl-[2-(2-phenylpropan-2-yl)phenyl]diazene

phenyl-[2-(2-phenylpropan-2-yl)phenyl]diazene (PubChem CID 88596726) has the molecular formula C21H20N2 and a molecular weight of 300.41 g/mol. Its IUPAC name is phenyl-[2-(2-phenylpropan-2-yl)phenyl]diazene.

Molecular Properties

Compound Namephenyl-[2-(2-phenylpropan-2-yl)phenyl]diazene
PubChem CID88596726
Molecular FormulaC21H20N2
Molecular Weight300.41 g/mol
Exact Mass300.16
IUPAC Namephenyl-[2-(2-phenylpropan-2-yl)phenyl]diazene
SMILESCC(C)(c1ccccc1)c1ccccc1/N=N/c1ccccc1
InChIInChI=1S/C21H20N2/c1-21(2,17-11-5-3-6-12-17)19-15-9-10-16-20(19)23-22-18-13-7-4-8-14-18/h3-16H,1-2H3/b23-22+
InChIKeyKCYQUPUTDHOLGT-GHVJWSGMSA-N
XLogP6.43
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500300.41
LogP ≤ 56.43
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

phenyl-[2-(2,4,4-trimethylpentan-2-yl)phenyl]diazene
CID 88827442
[2-methoxy-3,5-bis(2-phenylpropan-2-yl)phenyl]-phenyldiazene
CID 21342333
2-(2-phenyldiazenylphenyl)propan-2-yl carbamate
CID 87148092
(3-tert-butylphenyl)-phenyldiazene
CID 141467290
2-phenylpropan-2-ylbenzene
CID 13065
benzene;2-(2-phenylpropan-2-yl)phenol;hydrate
CID 174709888
2-(2-phenylpropan-2-yl)phenol;hydrate
CID 174697950
2-phenyldiazenylphenol
CID 16897
(4-tert-butyl-2-iodophenyl)-phenyldiazene
CID 11325979
1-(2-phenylpropan-2-yl)-2-[2-(2-phenylpropan-2-yl)phenyl]sulfanylbenzene
CID 156695476
[3,5-bis(2-phenylpropan-2-yl)phenyl]-(2-nitrophenyl)diazene
CID 141047377
diphenyldiazene;hydrofluoride
CID 174857584

Frequently Asked Questions

What is the IUPAC name of phenyl-[2-(2-phenylpropan-2-yl)phenyl]diazene?
The IUPAC name of phenyl-[2-(2-phenylpropan-2-yl)phenyl]diazene (CID 88596726) is phenyl-[2-(2-phenylpropan-2-yl)phenyl]diazene.
What is the SMILES notation for phenyl-[2-(2-phenylpropan-2-yl)phenyl]diazene?
The canonical SMILES for phenyl-[2-(2-phenylpropan-2-yl)phenyl]diazene is CC(C)(c1ccccc1)c1ccccc1/N=N/c1ccccc1.
What is the InChIKey of phenyl-[2-(2-phenylpropan-2-yl)phenyl]diazene?
The InChIKey is KCYQUPUTDHOLGT-GHVJWSGMSA-N. The full InChI is InChI=1S/C21H20N2/c1-21(2,17-11-5-3-6-12-17)19-15-9-10-16-20(19)23-22-18-13-7-4-8-14-18/h3-16H,1-2H3/b23-22+.
What are the key properties of phenyl-[2-(2-phenylpropan-2-yl)phenyl]diazene?
phenyl-[2-(2-phenylpropan-2-yl)phenyl]diazene has a molecular weight of 300.41 g/mol, XLogP of 6.43, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl-[2-(2-phenylpropan-2-yl)phenyl]diazene is sourced from PubChem (CID 88596726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).