6-fluoro-2-[4-[2-(methoxymethyl)phenyl]phenyl]-4-methylquinoline

C24H20FNO — CID 170148664

IUPAC6-fluoro-2-[4-[2-(methoxymethyl)phenyl]phenyl]-4-methylquinoline
SMILESCOCc1ccccc1-c1ccc(-c2cc(C)c3cc(F)ccc3n2)cc1
InChIInChI=1S/C24H20FNO/c1-16-13-24(26-23-12-11-20(25)14-22(16)23)18-9-7-17(8-10-18)21-6-4-3-5-19(21)15-27-2/h3-14H,15H2,1-2H3
InChIKeyQLLBYLNUEUUXLT-UHFFFAOYSA-N
MW357.43 g/mol
LogP6.16
Rot. Bonds4

About 6-fluoro-2-[4-[2-(methoxymethyl)phenyl]phenyl]-4-methylquinoline

6-fluoro-2-[4-[2-(methoxymethyl)phenyl]phenyl]-4-methylquinoline (PubChem CID 170148664) has the molecular formula C24H20FNO and a molecular weight of 357.43 g/mol. Its IUPAC name is 6-fluoro-2-[4-[2-(methoxymethyl)phenyl]phenyl]-4-methylquinoline.

Molecular Properties

Compound Name6-fluoro-2-[4-[2-(methoxymethyl)phenyl]phenyl]-4-methylquinoline
PubChem CID170148664
Molecular FormulaC24H20FNO
Molecular Weight357.43 g/mol
Exact Mass357.15
IUPAC Name6-fluoro-2-[4-[2-(methoxymethyl)phenyl]phenyl]-4-methylquinoline
SMILESCOCc1ccccc1-c1ccc(-c2cc(C)c3cc(F)ccc3n2)cc1
InChIInChI=1S/C24H20FNO/c1-16-13-24(26-23-12-11-20(25)14-22(16)23)18-9-7-17(8-10-18)21-6-4-3-5-19(21)15-27-2/h3-14H,15H2,1-2H3
InChIKeyQLLBYLNUEUUXLT-UHFFFAOYSA-N
XLogP6.16
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500357.43
LogP ≤ 56.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 6-fluoro-2-[4-[2-(methoxymethyl)phenyl]phenyl]-4-methylquinoline 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 6-fluoro-2-[4-[2-(methoxymethyl)phenyl]phenyl]-4-methylquinoline?
The IUPAC name of 6-fluoro-2-[4-[2-(methoxymethyl)phenyl]phenyl]-4-methylquinoline (CID 170148664) is 6-fluoro-2-[4-[2-(methoxymethyl)phenyl]phenyl]-4-methylquinoline.
What is the SMILES notation for 6-fluoro-2-[4-[2-(methoxymethyl)phenyl]phenyl]-4-methylquinoline?
The canonical SMILES for 6-fluoro-2-[4-[2-(methoxymethyl)phenyl]phenyl]-4-methylquinoline is COCc1ccccc1-c1ccc(-c2cc(C)c3cc(F)ccc3n2)cc1.
What is the InChIKey of 6-fluoro-2-[4-[2-(methoxymethyl)phenyl]phenyl]-4-methylquinoline?
The InChIKey is QLLBYLNUEUUXLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20FNO/c1-16-13-24(26-23-12-11-20(25)14-22(16)23)18-9-7-17(8-10-18)21-6-4-3-5-19(21)15-27-2/h3-14H,15H2,1-2H3.
What are the key properties of 6-fluoro-2-[4-[2-(methoxymethyl)phenyl]phenyl]-4-methylquinoline?
6-fluoro-2-[4-[2-(methoxymethyl)phenyl]phenyl]-4-methylquinoline has a molecular weight of 357.43 g/mol, XLogP of 6.16, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-2-[4-[2-(methoxymethyl)phenyl]phenyl]-4-methylquinoline is sourced from PubChem (CID 170148664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).