5,8-difluoro-4-methylquinoline

C10H7F2N — CID 82580898

IUPAC5,8-difluoro-4-methylquinoline
SMILESCc1ccnc2c(F)ccc(F)c12
InChIInChI=1S/C10H7F2N/c1-6-4-5-13-10-8(12)3-2-7(11)9(6)10/h2-5H,1H3
InChIKeyLEYOINNBJXEJGU-UHFFFAOYSA-N
MW179.17 g/mol
LogP2.82
Rot. Bonds

About 5,8-difluoro-4-methylquinoline

5,8-difluoro-4-methylquinoline (PubChem CID 82580898) has the molecular formula C10H7F2N and a molecular weight of 179.17 g/mol. Its IUPAC name is 5,8-difluoro-4-methylquinoline.

Molecular Properties

Compound Name5,8-difluoro-4-methylquinoline
PubChem CID82580898
Molecular FormulaC10H7F2N
Molecular Weight179.17 g/mol
Exact Mass179.05
IUPAC Name5,8-difluoro-4-methylquinoline
SMILESCc1ccnc2c(F)ccc(F)c12
InChIInChI=1S/C10H7F2N/c1-6-4-5-13-10-8(12)3-2-7(11)9(6)10/h2-5H,1H3
InChIKeyLEYOINNBJXEJGU-UHFFFAOYSA-N
XLogP2.82
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.17
LogP ≤ 52.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 5,8-difluoro-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

Related Compounds

5,8-difluoro-N-methylquinolin-4-amine
CID 62192239
4,5,6,7-tetramethyl-1,10-phenanthroline
CID 67115643
4-chloro-8-fluoro-5-methylquinazoline
CID 104782222
5,8-difluoro-1-methylisoquinoline
CID 125458346
6,8-difluoro-4-methylquinoline;ethane
CID 142378188
4,8-dibromo-5-fluoroquinoline
CID 107627841
4-chloro-8-fluoro-2,3,5-trimethylquinoline
CID 60996951
4-chloro-8-fluoro-5-iodo-3-methylquinoline
CID 171373210
8-fluoro-5-methoxyquinoline-4-carbaldehyde
CID 172633663
5,8-difluoro-3-methyl-4-phenylsulfanylquinoline
CID 142826297
(8-fluoro-2,3,5-trimethylquinolin-4-yl)hydrazine
CID 62252075
4,7-difluoro-3-methyl-2H-indazole
CID 70307019

Frequently Asked Questions

What is the IUPAC name of 5,8-difluoro-4-methylquinoline?
The IUPAC name of 5,8-difluoro-4-methylquinoline (CID 82580898) is 5,8-difluoro-4-methylquinoline.
What is the SMILES notation for 5,8-difluoro-4-methylquinoline?
The canonical SMILES for 5,8-difluoro-4-methylquinoline is Cc1ccnc2c(F)ccc(F)c12.
What is the InChIKey of 5,8-difluoro-4-methylquinoline?
The InChIKey is LEYOINNBJXEJGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7F2N/c1-6-4-5-13-10-8(12)3-2-7(11)9(6)10/h2-5H,1H3.
What are the key properties of 5,8-difluoro-4-methylquinoline?
5,8-difluoro-4-methylquinoline has a molecular weight of 179.17 g/mol, XLogP of 2.82, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5,8-difluoro-4-methylquinoline is sourced from PubChem (CID 82580898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).