2-(3,5-dimethylphenyl)-7-phenylquinoline

C23H19N — CID 58162359

IUPAC2-(3,5-dimethylphenyl)-7-phenylquinoline
SMILESCc1cc(C)cc(-c2ccc3ccc(-c4ccccc4)cc3n2)c1
InChIInChI=1S/C23H19N/c1-16-12-17(2)14-21(13-16)22-11-10-19-8-9-20(15-23(19)24-22)18-6-4-3-5-7-18/h3-15H,1-2H3
InChIKeyYXEYSJYTHYBBME-UHFFFAOYSA-N
MW309.41 g/mol
LogP6.19
Rot. Bonds2

About 2-(3,5-dimethylphenyl)-7-phenylquinoline

2-(3,5-dimethylphenyl)-7-phenylquinoline (PubChem CID 58162359) has the molecular formula C23H19N and a molecular weight of 309.41 g/mol. Its IUPAC name is 2-(3,5-dimethylphenyl)-7-phenylquinoline.

Molecular Properties

Compound Name2-(3,5-dimethylphenyl)-7-phenylquinoline
PubChem CID58162359
Molecular FormulaC23H19N
Molecular Weight309.41 g/mol
Exact Mass309.15
IUPAC Name2-(3,5-dimethylphenyl)-7-phenylquinoline
SMILESCc1cc(C)cc(-c2ccc3ccc(-c4ccccc4)cc3n2)c1
InChIInChI=1S/C23H19N/c1-16-12-17(2)14-21(13-16)22-11-10-19-8-9-20(15-23(19)24-22)18-6-4-3-5-7-18/h3-15H,1-2H3
InChIKeyYXEYSJYTHYBBME-UHFFFAOYSA-N
XLogP6.19
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500309.41
LogP ≤ 56.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dimethylphenyl)-7-phenylquinoline?
The IUPAC name of 2-(3,5-dimethylphenyl)-7-phenylquinoline (CID 58162359) is 2-(3,5-dimethylphenyl)-7-phenylquinoline.
What is the SMILES notation for 2-(3,5-dimethylphenyl)-7-phenylquinoline?
The canonical SMILES for 2-(3,5-dimethylphenyl)-7-phenylquinoline is Cc1cc(C)cc(-c2ccc3ccc(-c4ccccc4)cc3n2)c1.
What is the InChIKey of 2-(3,5-dimethylphenyl)-7-phenylquinoline?
The InChIKey is YXEYSJYTHYBBME-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19N/c1-16-12-17(2)14-21(13-16)22-11-10-19-8-9-20(15-23(19)24-22)18-6-4-3-5-7-18/h3-15H,1-2H3.
What are the key properties of 2-(3,5-dimethylphenyl)-7-phenylquinoline?
2-(3,5-dimethylphenyl)-7-phenylquinoline has a molecular weight of 309.41 g/mol, XLogP of 6.19, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dimethylphenyl)-7-phenylquinoline is sourced from PubChem (CID 58162359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).