1-(6-fluoro-2,4-dimethylquinolin-8-yl)ethanol

C13H14FNO — CID 82575954

IUPAC1-(6-fluoro-2,4-dimethylquinolin-8-yl)ethanol
SMILESCc1cc(C)c2cc(F)cc(C(C)O)c2n1
InChIInChI=1S/C13H14FNO/c1-7-4-8(2)15-13-11(7)5-10(14)6-12(13)9(3)16/h4-6,9,16H,1-3H3
InChIKeyLXWTYPSZZLMBCX-UHFFFAOYSA-N
MW219.26 g/mol
LogP3.04
Rot. Bonds1

About 1-(6-fluoro-2,4-dimethylquinolin-8-yl)ethanol

1-(6-fluoro-2,4-dimethylquinolin-8-yl)ethanol (PubChem CID 82575954) has the molecular formula C13H14FNO and a molecular weight of 219.26 g/mol. Its IUPAC name is 1-(6-fluoro-2,4-dimethylquinolin-8-yl)ethanol.

Molecular Properties

Compound Name1-(6-fluoro-2,4-dimethylquinolin-8-yl)ethanol
PubChem CID82575954
Molecular FormulaC13H14FNO
Molecular Weight219.26 g/mol
Exact Mass219.11
IUPAC Name1-(6-fluoro-2,4-dimethylquinolin-8-yl)ethanol
SMILESCc1cc(C)c2cc(F)cc(C(C)O)c2n1
InChIInChI=1S/C13H14FNO/c1-7-4-8(2)15-13-11(7)5-10(14)6-12(13)9(3)16/h4-6,9,16H,1-3H3
InChIKeyLXWTYPSZZLMBCX-UHFFFAOYSA-N
XLogP3.04
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.26
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(6-fluoro-2,4-dimethylquinolin-8-yl)ethanol?
The IUPAC name of 1-(6-fluoro-2,4-dimethylquinolin-8-yl)ethanol (CID 82575954) is 1-(6-fluoro-2,4-dimethylquinolin-8-yl)ethanol.
What is the SMILES notation for 1-(6-fluoro-2,4-dimethylquinolin-8-yl)ethanol?
The canonical SMILES for 1-(6-fluoro-2,4-dimethylquinolin-8-yl)ethanol is Cc1cc(C)c2cc(F)cc(C(C)O)c2n1.
What is the InChIKey of 1-(6-fluoro-2,4-dimethylquinolin-8-yl)ethanol?
The InChIKey is LXWTYPSZZLMBCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14FNO/c1-7-4-8(2)15-13-11(7)5-10(14)6-12(13)9(3)16/h4-6,9,16H,1-3H3.
What are the key properties of 1-(6-fluoro-2,4-dimethylquinolin-8-yl)ethanol?
1-(6-fluoro-2,4-dimethylquinolin-8-yl)ethanol has a molecular weight of 219.26 g/mol, XLogP of 3.04, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-fluoro-2,4-dimethylquinolin-8-yl)ethanol is sourced from PubChem (CID 82575954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).