1-[4-(2,3-dimethylphenyl)phenyl]naphthalene

C24H20 — CID 171799142

IUPAC1-[4-(2,3-dimethylphenyl)phenyl]naphthalene
SMILESCc1cccc(-c2ccc(-c3cccc4ccccc34)cc2)c1C
InChIInChI=1S/C24H20/c1-17-7-5-11-22(18(17)2)20-13-15-21(16-14-20)24-12-6-9-19-8-3-4-10-23(19)24/h3-16H,1-2H3
InChIKeyOAIHYHXQMQLZNG-UHFFFAOYSA-N
MW308.42 g/mol
LogP6.79
Rot. Bonds2

About 1-[4-(2,3-dimethylphenyl)phenyl]naphthalene

1-[4-(2,3-dimethylphenyl)phenyl]naphthalene (PubChem CID 171799142) has the molecular formula C24H20 and a molecular weight of 308.42 g/mol. Its IUPAC name is 1-[4-(2,3-dimethylphenyl)phenyl]naphthalene.

Molecular Properties

Compound Name1-[4-(2,3-dimethylphenyl)phenyl]naphthalene
PubChem CID171799142
Molecular FormulaC24H20
Molecular Weight308.42 g/mol
Exact Mass308.16
IUPAC Name1-[4-(2,3-dimethylphenyl)phenyl]naphthalene
SMILESCc1cccc(-c2ccc(-c3cccc4ccccc34)cc2)c1C
InChIInChI=1S/C24H20/c1-17-7-5-11-22(18(17)2)20-13-15-21(16-14-20)24-12-6-9-19-8-3-4-10-23(19)24/h3-16H,1-2H3
InChIKeyOAIHYHXQMQLZNG-UHFFFAOYSA-N
XLogP6.79
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms24
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500308.42
LogP ≤ 56.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-[4-(2,3-dimethylphenyl)phenyl]naphthalene?
The IUPAC name of 1-[4-(2,3-dimethylphenyl)phenyl]naphthalene (CID 171799142) is 1-[4-(2,3-dimethylphenyl)phenyl]naphthalene.
What is the SMILES notation for 1-[4-(2,3-dimethylphenyl)phenyl]naphthalene?
The canonical SMILES for 1-[4-(2,3-dimethylphenyl)phenyl]naphthalene is Cc1cccc(-c2ccc(-c3cccc4ccccc34)cc2)c1C.
What is the InChIKey of 1-[4-(2,3-dimethylphenyl)phenyl]naphthalene?
The InChIKey is OAIHYHXQMQLZNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20/c1-17-7-5-11-22(18(17)2)20-13-15-21(16-14-20)24-12-6-9-19-8-3-4-10-23(19)24/h3-16H,1-2H3.
What are the key properties of 1-[4-(2,3-dimethylphenyl)phenyl]naphthalene?
1-[4-(2,3-dimethylphenyl)phenyl]naphthalene has a molecular weight of 308.42 g/mol, XLogP of 6.79, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(2,3-dimethylphenyl)phenyl]naphthalene is sourced from PubChem (CID 171799142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).