[6-(4-fluorophenyl)-2,2,4-trimethyl-1H-quinolin-5-yl]methanol

C19H20FNO — CID 58026939

IUPAC[6-(4-fluorophenyl)-2,2,4-trimethyl-1H-quinolin-5-yl]methanol
SMILESCC1=CC(C)(C)Nc2ccc(-c3ccc(F)cc3)c(CO)c21
InChIInChI=1S/C19H20FNO/c1-12-10-19(2,3)21-17-9-8-15(16(11-22)18(12)17)13-4-6-14(20)7-5-13/h4-10,21-22H,11H2,1-3H3
InChIKeyFWDNUEKUQNKZHR-UHFFFAOYSA-N
MW297.37 g/mol
LogP4.59
Rot. Bonds2

About [6-(4-fluorophenyl)-2,2,4-trimethyl-1H-quinolin-5-yl]methanol

[6-(4-fluorophenyl)-2,2,4-trimethyl-1H-quinolin-5-yl]methanol (PubChem CID 58026939) has the molecular formula C19H20FNO and a molecular weight of 297.37 g/mol. Its IUPAC name is [6-(4-fluorophenyl)-2,2,4-trimethyl-1H-quinolin-5-yl]methanol.

Molecular Properties

Compound Name[6-(4-fluorophenyl)-2,2,4-trimethyl-1H-quinolin-5-yl]methanol
PubChem CID58026939
Molecular FormulaC19H20FNO
Molecular Weight297.37 g/mol
Exact Mass297.15
IUPAC Name[6-(4-fluorophenyl)-2,2,4-trimethyl-1H-quinolin-5-yl]methanol
SMILESCC1=CC(C)(C)Nc2ccc(-c3ccc(F)cc3)c(CO)c21
InChIInChI=1S/C19H20FNO/c1-12-10-19(2,3)21-17-9-8-15(16(11-22)18(12)17)13-4-6-14(20)7-5-13/h4-10,21-22H,11H2,1-3H3
InChIKeyFWDNUEKUQNKZHR-UHFFFAOYSA-N
XLogP4.59
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.37
LogP ≤ 54.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [6-(4-fluorophenyl)-2,2,4-trimethyl-1H-quinolin-5-yl]methanol?
The IUPAC name of [6-(4-fluorophenyl)-2,2,4-trimethyl-1H-quinolin-5-yl]methanol (CID 58026939) is [6-(4-fluorophenyl)-2,2,4-trimethyl-1H-quinolin-5-yl]methanol.
What is the SMILES notation for [6-(4-fluorophenyl)-2,2,4-trimethyl-1H-quinolin-5-yl]methanol?
The canonical SMILES for [6-(4-fluorophenyl)-2,2,4-trimethyl-1H-quinolin-5-yl]methanol is CC1=CC(C)(C)Nc2ccc(-c3ccc(F)cc3)c(CO)c21.
What is the InChIKey of [6-(4-fluorophenyl)-2,2,4-trimethyl-1H-quinolin-5-yl]methanol?
The InChIKey is FWDNUEKUQNKZHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20FNO/c1-12-10-19(2,3)21-17-9-8-15(16(11-22)18(12)17)13-4-6-14(20)7-5-13/h4-10,21-22H,11H2,1-3H3.
What are the key properties of [6-(4-fluorophenyl)-2,2,4-trimethyl-1H-quinolin-5-yl]methanol?
[6-(4-fluorophenyl)-2,2,4-trimethyl-1H-quinolin-5-yl]methanol has a molecular weight of 297.37 g/mol, XLogP of 4.59, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(4-fluorophenyl)-2,2,4-trimethyl-1H-quinolin-5-yl]methanol is sourced from PubChem (CID 58026939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).