1-(2-fluorophenyl)-1-quinolin-6-ylethanol

C17H14FNO — CID 81215960

IUPAC1-(2-fluorophenyl)-1-quinolin-6-ylethanol
SMILESCC(O)(c1ccc2ncccc2c1)c1ccccc1F
InChIInChI=1S/C17H14FNO/c1-17(20,14-6-2-3-7-15(14)18)13-8-9-16-12(11-13)5-4-10-19-16/h2-11,20H,1H3
InChIKeyXPPOQIOWUTWVLB-UHFFFAOYSA-N
MW267.30 g/mol
LogP3.63
Rot. Bonds2

About 1-(2-fluorophenyl)-1-quinolin-6-ylethanol

1-(2-fluorophenyl)-1-quinolin-6-ylethanol (PubChem CID 81215960) has the molecular formula C17H14FNO and a molecular weight of 267.30 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-1-quinolin-6-ylethanol.

Molecular Properties

Compound Name1-(2-fluorophenyl)-1-quinolin-6-ylethanol
PubChem CID81215960
Molecular FormulaC17H14FNO
Molecular Weight267.30 g/mol
Exact Mass267.11
IUPAC Name1-(2-fluorophenyl)-1-quinolin-6-ylethanol
SMILESCC(O)(c1ccc2ncccc2c1)c1ccccc1F
InChIInChI=1S/C17H14FNO/c1-17(20,14-6-2-3-7-15(14)18)13-8-9-16-12(11-13)5-4-10-19-16/h2-11,20H,1H3
InChIKeyXPPOQIOWUTWVLB-UHFFFAOYSA-N
XLogP3.63
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.30
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)-1-quinolin-6-ylethanol?
The IUPAC name of 1-(2-fluorophenyl)-1-quinolin-6-ylethanol (CID 81215960) is 1-(2-fluorophenyl)-1-quinolin-6-ylethanol.
What is the SMILES notation for 1-(2-fluorophenyl)-1-quinolin-6-ylethanol?
The canonical SMILES for 1-(2-fluorophenyl)-1-quinolin-6-ylethanol is CC(O)(c1ccc2ncccc2c1)c1ccccc1F.
What is the InChIKey of 1-(2-fluorophenyl)-1-quinolin-6-ylethanol?
The InChIKey is XPPOQIOWUTWVLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14FNO/c1-17(20,14-6-2-3-7-15(14)18)13-8-9-16-12(11-13)5-4-10-19-16/h2-11,20H,1H3.
What are the key properties of 1-(2-fluorophenyl)-1-quinolin-6-ylethanol?
1-(2-fluorophenyl)-1-quinolin-6-ylethanol has a molecular weight of 267.30 g/mol, XLogP of 3.63, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)-1-quinolin-6-ylethanol is sourced from PubChem (CID 81215960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).