8-[2-[2-(2-fluorophenoxy)ethoxy]ethoxy]-2-methylquinoline

C20H20FNO3 — CID 2184547

IUPAC8-[2-[2-(2-fluorophenoxy)ethoxy]ethoxy]-2-methylquinoline
SMILESCc1ccc2cccc(OCCOCCOc3ccccc3F)c2n1
InChIInChI=1S/C20H20FNO3/c1-15-9-10-16-5-4-8-19(20(16)22-15)25-14-12-23-11-13-24-18-7-3-2-6-17(18)21/h2-10H,11-14H2,1H3
InChIKeyNCWMPDKVSLSRHJ-UHFFFAOYSA-N
MW341.38 g/mol
LogP4.16
Rot. Bonds8

About 8-[2-[2-(2-fluorophenoxy)ethoxy]ethoxy]-2-methylquinoline

8-[2-[2-(2-fluorophenoxy)ethoxy]ethoxy]-2-methylquinoline (PubChem CID 2184547) has the molecular formula C20H20FNO3 and a molecular weight of 341.38 g/mol. Its IUPAC name is 8-[2-[2-(2-fluorophenoxy)ethoxy]ethoxy]-2-methylquinoline.

Molecular Properties

Compound Name8-[2-[2-(2-fluorophenoxy)ethoxy]ethoxy]-2-methylquinoline
PubChem CID2184547
Molecular FormulaC20H20FNO3
Molecular Weight341.38 g/mol
Exact Mass341.14
IUPAC Name8-[2-[2-(2-fluorophenoxy)ethoxy]ethoxy]-2-methylquinoline
SMILESCc1ccc2cccc(OCCOCCOc3ccccc3F)c2n1
InChIInChI=1S/C20H20FNO3/c1-15-9-10-16-5-4-8-19(20(16)22-15)25-14-12-23-11-13-24-18-7-3-2-6-17(18)21/h2-10H,11-14H2,1H3
InChIKeyNCWMPDKVSLSRHJ-UHFFFAOYSA-N
XLogP4.16
TPSA40.58 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.38
LogP ≤ 54.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

8-[2-[2-(4-chloro-2-methylphenoxy)ethoxy]ethoxy]-2-methylquinoline
CID 2182613
8-[2-(4-chlorophenoxy)ethoxy]-2-methylquinoline
CID 2299353
1-[2-[2-(2-methylquinolin-8-yl)oxyethoxy]phenyl]ethanone
CID 2994272
8-[2-[2-(4-chloro-3-ethylphenoxy)ethoxy]ethoxy]-2-methylquinoline
CID 2183491
8-[4-(2-fluorophenoxy)butoxy]quinoline
CID 4302402
4-(2-methylquinolin-8-yl)oxybutan-2-amine
CID 43169778
2-methyl-8-pent-4-ynoxyquinoline
CID 75395956
8-[2-(2-chloro-4-methylphenoxy)ethoxy]-2-methylquinoline
CID 2182910
1-ethoxy-2-[2-[2-(2-fluorophenoxy)ethoxy]ethoxy]benzene
CID 2283298
2-fluoro-6-(2-methylquinolin-8-yl)oxyaniline
CID 60789943
2-methyl-8-[4-(2-nitrophenoxy)butoxy]quinoline
CID 2182124
1-[2-(2-chloroethoxy)ethoxy]-2-fluorobenzene
CID 63663798

Frequently Asked Questions

What is the IUPAC name of 8-[2-[2-(2-fluorophenoxy)ethoxy]ethoxy]-2-methylquinoline?
The IUPAC name of 8-[2-[2-(2-fluorophenoxy)ethoxy]ethoxy]-2-methylquinoline (CID 2184547) is 8-[2-[2-(2-fluorophenoxy)ethoxy]ethoxy]-2-methylquinoline.
What is the SMILES notation for 8-[2-[2-(2-fluorophenoxy)ethoxy]ethoxy]-2-methylquinoline?
The canonical SMILES for 8-[2-[2-(2-fluorophenoxy)ethoxy]ethoxy]-2-methylquinoline is Cc1ccc2cccc(OCCOCCOc3ccccc3F)c2n1.
What is the InChIKey of 8-[2-[2-(2-fluorophenoxy)ethoxy]ethoxy]-2-methylquinoline?
The InChIKey is NCWMPDKVSLSRHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20FNO3/c1-15-9-10-16-5-4-8-19(20(16)22-15)25-14-12-23-11-13-24-18-7-3-2-6-17(18)21/h2-10H,11-14H2,1H3.
What are the key properties of 8-[2-[2-(2-fluorophenoxy)ethoxy]ethoxy]-2-methylquinoline?
8-[2-[2-(2-fluorophenoxy)ethoxy]ethoxy]-2-methylquinoline has a molecular weight of 341.38 g/mol, XLogP of 4.16, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[2-[2-(2-fluorophenoxy)ethoxy]ethoxy]-2-methylquinoline is sourced from PubChem (CID 2184547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).