2-(3,5-dimethylphenyl)-3-methylquinoline

C18H17N — CID 59273843

IUPAC2-(3,5-dimethylphenyl)-3-methylquinoline
SMILESCc1cc(C)cc(-c2nc3ccccc3cc2C)c1
InChIInChI=1S/C18H17N/c1-12-8-13(2)10-16(9-12)18-14(3)11-15-6-4-5-7-17(15)19-18/h4-11H,1-3H3
InChIKeyRKDJAZHBOJQZFK-UHFFFAOYSA-N
MW247.34 g/mol
LogP4.83
Rot. Bonds1

About 2-(3,5-dimethylphenyl)-3-methylquinoline

2-(3,5-dimethylphenyl)-3-methylquinoline (PubChem CID 59273843) has the molecular formula C18H17N and a molecular weight of 247.34 g/mol. Its IUPAC name is 2-(3,5-dimethylphenyl)-3-methylquinoline.

Molecular Properties

Compound Name2-(3,5-dimethylphenyl)-3-methylquinoline
PubChem CID59273843
Molecular FormulaC18H17N
Molecular Weight247.34 g/mol
Exact Mass247.14
IUPAC Name2-(3,5-dimethylphenyl)-3-methylquinoline
SMILESCc1cc(C)cc(-c2nc3ccccc3cc2C)c1
InChIInChI=1S/C18H17N/c1-12-8-13(2)10-16(9-12)18-14(3)11-15-6-4-5-7-17(15)19-18/h4-11H,1-3H3
InChIKeyRKDJAZHBOJQZFK-UHFFFAOYSA-N
XLogP4.83
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 54.83
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)-3-methylquinoline?
The IUPAC name of 2-(3,5-dimethylphenyl)-3-methylquinoline (CID 59273843) is 2-(3,5-dimethylphenyl)-3-methylquinoline.
What is the SMILES notation for 2-(3,5-dimethylphenyl)-3-methylquinoline?
The canonical SMILES for 2-(3,5-dimethylphenyl)-3-methylquinoline is Cc1cc(C)cc(-c2nc3ccccc3cc2C)c1.
What is the InChIKey of 2-(3,5-dimethylphenyl)-3-methylquinoline?
The InChIKey is RKDJAZHBOJQZFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N/c1-12-8-13(2)10-16(9-12)18-14(3)11-15-6-4-5-7-17(15)19-18/h4-11H,1-3H3.
What are the key properties of 2-(3,5-dimethylphenyl)-3-methylquinoline?
2-(3,5-dimethylphenyl)-3-methylquinoline has a molecular weight of 247.34 g/mol, XLogP of 4.83, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dimethylphenyl)-3-methylquinoline is sourced from PubChem (CID 59273843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).