1,2-diphenylnaphthalene

C22H16 — CID 11208267

IUPAC1,2-diphenylnaphthalene
SMILESc1ccc(-c2ccc3ccccc3c2-c2ccccc2)cc1
InChIInChI=1S/C22H16/c1-3-9-17(10-4-1)21-16-15-18-11-7-8-14-20(18)22(21)19-12-5-2-6-13-19/h1-16H
InChIKeyZNVZNEACQAUNGE-UHFFFAOYSA-N
MW280.37 g/mol
LogP6.17
Rot. Bonds2

About 1,2-diphenylnaphthalene

1,2-diphenylnaphthalene (PubChem CID 11208267) has the molecular formula C22H16 and a molecular weight of 280.37 g/mol. Its IUPAC name is 1,2-diphenylnaphthalene.

Molecular Properties

Compound Name1,2-diphenylnaphthalene
PubChem CID11208267
Molecular FormulaC22H16
Molecular Weight280.37 g/mol
Exact Mass280.13
IUPAC Name1,2-diphenylnaphthalene
SMILESc1ccc(-c2ccc3ccccc3c2-c2ccccc2)cc1
InChIInChI=1S/C22H16/c1-3-9-17(10-4-1)21-16-15-18-11-7-8-14-20(18)22(21)19-12-5-2-6-13-19/h1-16H
InChIKeyZNVZNEACQAUNGE-UHFFFAOYSA-N
XLogP6.17
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms22
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500280.37
LogP ≤ 56.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1,2-diphenylnaphthalene?
The IUPAC name of 1,2-diphenylnaphthalene (CID 11208267) is 1,2-diphenylnaphthalene.
What is the SMILES notation for 1,2-diphenylnaphthalene?
The canonical SMILES for 1,2-diphenylnaphthalene is c1ccc(-c2ccc3ccccc3c2-c2ccccc2)cc1.
What is the InChIKey of 1,2-diphenylnaphthalene?
The InChIKey is ZNVZNEACQAUNGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H16/c1-3-9-17(10-4-1)21-16-15-18-11-7-8-14-20(18)22(21)19-12-5-2-6-13-19/h1-16H.
What are the key properties of 1,2-diphenylnaphthalene?
1,2-diphenylnaphthalene has a molecular weight of 280.37 g/mol, XLogP of 6.17, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-diphenylnaphthalene is sourced from PubChem (CID 11208267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).