5,7-dimethyl-3-phenylquinoline

C17H15N — CID 102579879

IUPAC5,7-dimethyl-3-phenylquinoline
SMILESCc1cc(C)c2cc(-c3ccccc3)cnc2c1
InChIInChI=1S/C17H15N/c1-12-8-13(2)16-10-15(11-18-17(16)9-12)14-6-4-3-5-7-14/h3-11H,1-2H3
InChIKeyMJLAVTIJQDIOPK-UHFFFAOYSA-N
MW233.31 g/mol
LogP4.52
Rot. Bonds1

About 5,7-dimethyl-3-phenylquinoline

5,7-dimethyl-3-phenylquinoline (PubChem CID 102579879) has the molecular formula C17H15N and a molecular weight of 233.31 g/mol. Its IUPAC name is 5,7-dimethyl-3-phenylquinoline.

Molecular Properties

Compound Name5,7-dimethyl-3-phenylquinoline
PubChem CID102579879
Molecular FormulaC17H15N
Molecular Weight233.31 g/mol
Exact Mass233.12
IUPAC Name5,7-dimethyl-3-phenylquinoline
SMILESCc1cc(C)c2cc(-c3ccccc3)cnc2c1
InChIInChI=1S/C17H15N/c1-12-8-13(2)16-10-15(11-18-17(16)9-12)14-6-4-3-5-7-14/h3-11H,1-2H3
InChIKeyMJLAVTIJQDIOPK-UHFFFAOYSA-N
XLogP4.52
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 54.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 5,7-dimethyl-3-phenylquinoline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5,7-dimethyl-3-phenylquinoline?
The IUPAC name of 5,7-dimethyl-3-phenylquinoline (CID 102579879) is 5,7-dimethyl-3-phenylquinoline.
What is the SMILES notation for 5,7-dimethyl-3-phenylquinoline?
The canonical SMILES for 5,7-dimethyl-3-phenylquinoline is Cc1cc(C)c2cc(-c3ccccc3)cnc2c1.
What is the InChIKey of 5,7-dimethyl-3-phenylquinoline?
The InChIKey is MJLAVTIJQDIOPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N/c1-12-8-13(2)16-10-15(11-18-17(16)9-12)14-6-4-3-5-7-14/h3-11H,1-2H3.
What are the key properties of 5,7-dimethyl-3-phenylquinoline?
5,7-dimethyl-3-phenylquinoline has a molecular weight of 233.31 g/mol, XLogP of 4.52, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5,7-dimethyl-3-phenylquinoline is sourced from PubChem (CID 102579879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).