2,4-diethyl-3-(4-fluorophenoxy)quinoline

C19H18FNO — CID 174766627

IUPAC2,4-diethyl-3-(4-fluorophenoxy)quinoline
SMILESCCc1nc2ccccc2c(CC)c1Oc1ccc(F)cc1
InChIInChI=1S/C19H18FNO/c1-3-15-16-7-5-6-8-18(16)21-17(4-2)19(15)22-14-11-9-13(20)10-12-14/h5-12H,3-4H2,1-2H3
InChIKeyVUIZCFFDUIULFK-UHFFFAOYSA-N
MW295.36 g/mol
LogP5.29
Rot. Bonds4

About 2,4-diethyl-3-(4-fluorophenoxy)quinoline

2,4-diethyl-3-(4-fluorophenoxy)quinoline (PubChem CID 174766627) has the molecular formula C19H18FNO and a molecular weight of 295.36 g/mol. Its IUPAC name is 2,4-diethyl-3-(4-fluorophenoxy)quinoline.

Molecular Properties

Compound Name2,4-diethyl-3-(4-fluorophenoxy)quinoline
PubChem CID174766627
Molecular FormulaC19H18FNO
Molecular Weight295.36 g/mol
Exact Mass295.14
IUPAC Name2,4-diethyl-3-(4-fluorophenoxy)quinoline
SMILESCCc1nc2ccccc2c(CC)c1Oc1ccc(F)cc1
InChIInChI=1S/C19H18FNO/c1-3-15-16-7-5-6-8-18(16)21-17(4-2)19(15)22-14-11-9-13(20)10-12-14/h5-12H,3-4H2,1-2H3
InChIKeyVUIZCFFDUIULFK-UHFFFAOYSA-N
XLogP5.29
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500295.36
LogP ≤ 55.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-(4-fluorophenoxy)-2-methylquinazoline
CID 101092876
3,5-diethyl-4-(4-fluorophenoxy)-1H-pyrazole
CID 91387915
4-[[4-(4-fluorophenoxy)phenyl]methyl]quinazolin-2-amine
CID 123262074
22-ethyl-21-azapentacyclo[12.8.0.02,7.08,13.015,20]docosa-1(14),2,4,6,8,10,12,15,17,19,21-undecaene
CID 129303440
4-ethylquinazolin-2-amine
CID 10352174
2-ethyl-4-(4-fluorophenyl)quinoline-3-carbaldehyde
CID 15125346
2-(4-fluorophenoxy)quinazolin-4-amine
CID 57221110
[4-(4-fluorophenyl)-2-propylquinolin-3-yl]methanol
CID 15125323
2-cyclopropyl-3-ethenyl-4-(4-fluorophenoxy)quinoline
CID 141286071
dilithium bis(2-ethyl-3-[4-[2-(2H-tetrazol-5-yl)phenyl]phenoxy]quinoline-4-carboxylate)
CID 139620443
4-ethyl-3H-pyrrolo[2,3-c]quinoline
CID 102294424
2-ethyl-3-[4-[2-(2-trityl-1,3-dihydrotetrazol-5-yl)phenyl]phenoxy]quinoline-4-carboxylic acid
CID 23298239

Frequently Asked Questions

What is the IUPAC name of 2,4-diethyl-3-(4-fluorophenoxy)quinoline?
The IUPAC name of 2,4-diethyl-3-(4-fluorophenoxy)quinoline (CID 174766627) is 2,4-diethyl-3-(4-fluorophenoxy)quinoline.
What is the SMILES notation for 2,4-diethyl-3-(4-fluorophenoxy)quinoline?
The canonical SMILES for 2,4-diethyl-3-(4-fluorophenoxy)quinoline is CCc1nc2ccccc2c(CC)c1Oc1ccc(F)cc1.
What is the InChIKey of 2,4-diethyl-3-(4-fluorophenoxy)quinoline?
The InChIKey is VUIZCFFDUIULFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18FNO/c1-3-15-16-7-5-6-8-18(16)21-17(4-2)19(15)22-14-11-9-13(20)10-12-14/h5-12H,3-4H2,1-2H3.
What are the key properties of 2,4-diethyl-3-(4-fluorophenoxy)quinoline?
2,4-diethyl-3-(4-fluorophenoxy)quinoline has a molecular weight of 295.36 g/mol, XLogP of 5.29, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-diethyl-3-(4-fluorophenoxy)quinoline is sourced from PubChem (CID 174766627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).