8-fluoro-4-[(2-fluorophenyl)methoxymethyl]-2-methylquinoline

C18H15F2NO — CID 172633638

IUPAC8-fluoro-4-[(2-fluorophenyl)methoxymethyl]-2-methylquinoline
SMILESCc1cc(COCc2ccccc2F)c2cccc(F)c2n1
InChIInChI=1S/C18H15F2NO/c1-12-9-14(15-6-4-8-17(20)18(15)21-12)11-22-10-13-5-2-3-7-16(13)19/h2-9H,10-11H2,1H3
InChIKeyHYBWEOVMCVAQRR-UHFFFAOYSA-N
MW299.32 g/mol
LogP4.54
Rot. Bonds4

About 8-fluoro-4-[(2-fluorophenyl)methoxymethyl]-2-methylquinoline

8-fluoro-4-[(2-fluorophenyl)methoxymethyl]-2-methylquinoline (PubChem CID 172633638) has the molecular formula C18H15F2NO and a molecular weight of 299.32 g/mol. Its IUPAC name is 8-fluoro-4-[(2-fluorophenyl)methoxymethyl]-2-methylquinoline.

Molecular Properties

Compound Name8-fluoro-4-[(2-fluorophenyl)methoxymethyl]-2-methylquinoline
PubChem CID172633638
Molecular FormulaC18H15F2NO
Molecular Weight299.32 g/mol
Exact Mass299.11
IUPAC Name8-fluoro-4-[(2-fluorophenyl)methoxymethyl]-2-methylquinoline
SMILESCc1cc(COCc2ccccc2F)c2cccc(F)c2n1
InChIInChI=1S/C18H15F2NO/c1-12-9-14(15-6-4-8-17(20)18(15)21-12)11-22-10-13-5-2-3-7-16(13)19/h2-9H,10-11H2,1H3
InChIKeyHYBWEOVMCVAQRR-UHFFFAOYSA-N
XLogP4.54
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.32
LogP ≤ 54.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 8-fluoro-4-[(2-fluorophenyl)methoxymethyl]-2-methylquinoline with MolForge

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

Launch Full Analysis

Related Compounds

9-Methoxyacridine
CID 99383
4-Methoxy-2-Phenylquinoline
CID 826247
2-(4,5-Dihydro-2-oxazolyl)quinoline
CID 828047
4-[1-(4-Methoxyphenyl)ethenyl]-2-methylquinoline
CID 91971313
1-Phenyl-1-(2-quinolinyl)ethanol
CID 273212
3-[(Benzyloxy)methyl]-5-fluoro-2-methylquinolin-4-amine
CID 11098484
Phenyl-[2-(trifluoromethyl)quinolin-4-yl]methanol
CID 18511481
2-[2-(4-Methoxyphenyl)ethyl]quinoline
CID 223220
[6-Fluoro-2-[4-(2-fluorophenyl)phenyl]-3-methylquinolin-4-yl]methanol
CID 10338613
1-(4-Fluorophenyl)-2-quinolin-2-ylethanol
CID 44346580
3-(Methoxymethyl)-5-(2-methylquinolin-7-yl)benzonitrile
CID 44432679
9-Acridinyl butyl ether
CID 45488807

Frequently Asked Questions

What is the IUPAC name of 8-fluoro-4-[(2-fluorophenyl)methoxymethyl]-2-methylquinoline?
The IUPAC name of 8-fluoro-4-[(2-fluorophenyl)methoxymethyl]-2-methylquinoline (CID 172633638) is 8-fluoro-4-[(2-fluorophenyl)methoxymethyl]-2-methylquinoline.
What is the SMILES notation for 8-fluoro-4-[(2-fluorophenyl)methoxymethyl]-2-methylquinoline?
The canonical SMILES for 8-fluoro-4-[(2-fluorophenyl)methoxymethyl]-2-methylquinoline is Cc1cc(COCc2ccccc2F)c2cccc(F)c2n1.
What is the InChIKey of 8-fluoro-4-[(2-fluorophenyl)methoxymethyl]-2-methylquinoline?
The InChIKey is HYBWEOVMCVAQRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15F2NO/c1-12-9-14(15-6-4-8-17(20)18(15)21-12)11-22-10-13-5-2-3-7-16(13)19/h2-9H,10-11H2,1H3.
What are the key properties of 8-fluoro-4-[(2-fluorophenyl)methoxymethyl]-2-methylquinoline?
8-fluoro-4-[(2-fluorophenyl)methoxymethyl]-2-methylquinoline has a molecular weight of 299.32 g/mol, XLogP of 4.54, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-fluoro-4-[(2-fluorophenyl)methoxymethyl]-2-methylquinoline is sourced from PubChem (CID 172633638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).