7-fluoro-3-(3-fluoro-5-methoxyphenyl)quinoline

C16H11F2NO — CID 157018506

IUPAC7-fluoro-3-(3-fluoro-5-methoxyphenyl)quinoline
SMILESCOc1cc(F)cc(-c2cnc3cc(F)ccc3c2)c1
InChIInChI=1S/C16H11F2NO/c1-20-15-6-11(5-14(18)7-15)12-4-10-2-3-13(17)8-16(10)19-9-12/h2-9H,1H3
InChIKeyKVGQDQDXCPOWCF-UHFFFAOYSA-N
MW271.27 g/mol
LogP4.19
Rot. Bonds2

About 7-fluoro-3-(3-fluoro-5-methoxyphenyl)quinoline

7-fluoro-3-(3-fluoro-5-methoxyphenyl)quinoline (PubChem CID 157018506) has the molecular formula C16H11F2NO and a molecular weight of 271.27 g/mol. Its IUPAC name is 7-fluoro-3-(3-fluoro-5-methoxyphenyl)quinoline.

Molecular Properties

Compound Name7-fluoro-3-(3-fluoro-5-methoxyphenyl)quinoline
PubChem CID157018506
Molecular FormulaC16H11F2NO
Molecular Weight271.27 g/mol
Exact Mass271.08
IUPAC Name7-fluoro-3-(3-fluoro-5-methoxyphenyl)quinoline
SMILESCOc1cc(F)cc(-c2cnc3cc(F)ccc3c2)c1
InChIInChI=1S/C16H11F2NO/c1-20-15-6-11(5-14(18)7-15)12-4-10-2-3-13(17)8-16(10)19-9-12/h2-9H,1H3
InChIKeyKVGQDQDXCPOWCF-UHFFFAOYSA-N
XLogP4.19
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.27
LogP ≤ 54.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-(3,5-dimethoxyphenyl)-6-fluoroisoquinoline
CID 25058376
5-(3-fluoro-5-methoxyphenyl)pyridin-3-amine
CID 168655350
2-(3-fluoro-5-methoxyphenyl)pyrazine
CID 166161834
7-fluoro-3-(3-methoxyphenyl)sulfonylquinoline
CID 91316778
1,3-difluoro-5-(4-methoxyphenyl)benzene
CID 11499528
1,3-bis(4-fluorophenyl)-5-methoxybenzene
CID 137385203
7-(4-ethylphenyl)-3-[4-(4-fluorophenyl)phenyl]quinoline
CID 170294733
1-fluoro-3-methoxy-5-(4-methylsulfanylphenyl)benzene
CID 70699755
7-fluoro-3-propan-2-ylquinoline
CID 118097497
(7-fluoroquinolin-3-yl) trifluoromethanesulfonate
CID 10063077
3-(3-fluoro-5-methoxyphenyl)-1H-pyrrole
CID 174803802
3-fluoro-4-(3-fluoro-5-methoxyphenyl)pyridine
CID 165479125

Frequently Asked Questions

What is the IUPAC name of 7-fluoro-3-(3-fluoro-5-methoxyphenyl)quinoline?
The IUPAC name of 7-fluoro-3-(3-fluoro-5-methoxyphenyl)quinoline (CID 157018506) is 7-fluoro-3-(3-fluoro-5-methoxyphenyl)quinoline.
What is the SMILES notation for 7-fluoro-3-(3-fluoro-5-methoxyphenyl)quinoline?
The canonical SMILES for 7-fluoro-3-(3-fluoro-5-methoxyphenyl)quinoline is COc1cc(F)cc(-c2cnc3cc(F)ccc3c2)c1.
What is the InChIKey of 7-fluoro-3-(3-fluoro-5-methoxyphenyl)quinoline?
The InChIKey is KVGQDQDXCPOWCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11F2NO/c1-20-15-6-11(5-14(18)7-15)12-4-10-2-3-13(17)8-16(10)19-9-12/h2-9H,1H3.
What are the key properties of 7-fluoro-3-(3-fluoro-5-methoxyphenyl)quinoline?
7-fluoro-3-(3-fluoro-5-methoxyphenyl)quinoline has a molecular weight of 271.27 g/mol, XLogP of 4.19, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-3-(3-fluoro-5-methoxyphenyl)quinoline is sourced from PubChem (CID 157018506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).