1-(2-fluorophenyl)-1-isoquinolin-8-ylethanol

C17H14FNO — CID 103142678

IUPAC1-(2-fluorophenyl)-1-isoquinolin-8-ylethanol
SMILESCC(O)(c1ccccc1F)c1cccc2ccncc12
InChIInChI=1S/C17H14FNO/c1-17(20,15-6-2-3-8-16(15)18)14-7-4-5-12-9-10-19-11-13(12)14/h2-11,20H,1H3
InChIKeyAZLPRJBBUSBMFH-UHFFFAOYSA-N
MW267.30 g/mol
LogP3.63
Rot. Bonds2

About 1-(2-fluorophenyl)-1-isoquinolin-8-ylethanol

1-(2-fluorophenyl)-1-isoquinolin-8-ylethanol (PubChem CID 103142678) has the molecular formula C17H14FNO and a molecular weight of 267.30 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-1-isoquinolin-8-ylethanol.

Molecular Properties

Compound Name1-(2-fluorophenyl)-1-isoquinolin-8-ylethanol
PubChem CID103142678
Molecular FormulaC17H14FNO
Molecular Weight267.30 g/mol
Exact Mass267.11
IUPAC Name1-(2-fluorophenyl)-1-isoquinolin-8-ylethanol
SMILESCC(O)(c1ccccc1F)c1cccc2ccncc12
InChIInChI=1S/C17H14FNO/c1-17(20,15-6-2-3-8-16(15)18)14-7-4-5-12-9-10-19-11-13(12)14/h2-11,20H,1H3
InChIKeyAZLPRJBBUSBMFH-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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Related Compounds

1-isoquinolin-8-yl-1-(2-methylphenyl)ethanol
CID 103142671
3-isoquinolin-8-ylpentan-3-ol
CID 103142702
2-isoquinolin-8-yl-1-methoxypropan-2-ol
CID 103142735
1-(4-fluorophenyl)-1-isoquinolin-5-ylethanol
CID 62811615
1-(2-fluorophenyl)-1-(3-fluoro-4-pyridinyl)propan-1-ol
CID 104737726
2-amino-1-isoquinolin-8-yl-1-phenylethanol
CID 103143061
1-(2-fluorophenyl)-1-[2-(trifluoromethyl)phenyl]ethanol
CID 62802798
isoquinolin-8-ol
CID 135441711
2-isoquinolin-5-yl-3-methylpentan-2-ol
CID 62813485
1-(2-fluorophenyl)-1-quinolin-6-ylethanol
CID 81215960
1-(2,3-difluoro-4-methylphenyl)-1-(2-fluorophenyl)ethanol
CID 107512082
1-isoquinolin-8-yl-1-(3-methoxyphenyl)ethanamine
CID 103143227

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)-1-isoquinolin-8-ylethanol?
The IUPAC name of 1-(2-fluorophenyl)-1-isoquinolin-8-ylethanol (CID 103142678) is 1-(2-fluorophenyl)-1-isoquinolin-8-ylethanol.
What is the SMILES notation for 1-(2-fluorophenyl)-1-isoquinolin-8-ylethanol?
The canonical SMILES for 1-(2-fluorophenyl)-1-isoquinolin-8-ylethanol is CC(O)(c1ccccc1F)c1cccc2ccncc12.
What is the InChIKey of 1-(2-fluorophenyl)-1-isoquinolin-8-ylethanol?
The InChIKey is AZLPRJBBUSBMFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14FNO/c1-17(20,15-6-2-3-8-16(15)18)14-7-4-5-12-9-10-19-11-13(12)14/h2-11,20H,1H3.
What are the key properties of 1-(2-fluorophenyl)-1-isoquinolin-8-ylethanol?
1-(2-fluorophenyl)-1-isoquinolin-8-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-isoquinolin-8-ylethanol is sourced from PubChem (CID 103142678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).