2-(2-fluorophenyl)-1-(4-methylquinolin-2-yl)ethanol

C18H16FNO — CID 114754909

IUPAC2-(2-fluorophenyl)-1-(4-methylquinolin-2-yl)ethanol
SMILESCc1cc(C(O)Cc2ccccc2F)nc2ccccc12
InChIInChI=1S/C18H16FNO/c1-12-10-17(20-16-9-5-3-7-14(12)16)18(21)11-13-6-2-4-8-15(13)19/h2-10,18,21H,11H2,1H3
InChIKeyISVOBZDHGWVMNC-UHFFFAOYSA-N
MW281.33 g/mol
LogP3.96
Rot. Bonds3

About 2-(2-fluorophenyl)-1-(4-methylquinolin-2-yl)ethanol

2-(2-fluorophenyl)-1-(4-methylquinolin-2-yl)ethanol (PubChem CID 114754909) has the molecular formula C18H16FNO and a molecular weight of 281.33 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-1-(4-methylquinolin-2-yl)ethanol.

Molecular Properties

Compound Name2-(2-fluorophenyl)-1-(4-methylquinolin-2-yl)ethanol
PubChem CID114754909
Molecular FormulaC18H16FNO
Molecular Weight281.33 g/mol
Exact Mass281.12
IUPAC Name2-(2-fluorophenyl)-1-(4-methylquinolin-2-yl)ethanol
SMILESCc1cc(C(O)Cc2ccccc2F)nc2ccccc12
InChIInChI=1S/C18H16FNO/c1-12-10-17(20-16-9-5-3-7-14(12)16)18(21)11-13-6-2-4-8-15(13)19/h2-10,18,21H,11H2,1H3
InChIKeyISVOBZDHGWVMNC-UHFFFAOYSA-N
XLogP3.96
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.33
LogP ≤ 53.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1R)-1-(4-methylquinolin-2-yl)butan-1-ol
CID 104969389
2-(2-amino-4-pyridinyl)-1-(4-methylquinolin-2-yl)ethanol
CID 114754949
1-(4-methylquinolin-2-yl)-2-propan-2-yloxyethanol
CID 114754836
(3,4-difluorophenyl)-(4-methylquinolin-2-yl)methanol
CID 114754840
2-(5-fluoro-2-methylphenyl)-1-quinoxalin-2-ylethanol
CID 107357762
1-(3-fluoro-4-methylphenyl)-2-(2-fluorophenyl)ethanol
CID 60798295
1-(4-methylquinolin-2-yl)-4-(oxolan-2-yl)butan-1-ol
CID 114754924
2-(2-fluorophenyl)-1-(6-methoxy-2-pyridinyl)ethanol
CID 103347996
1-(2,6-difluoro-3-methylphenyl)-2-(2-fluorophenyl)ethanol
CID 82815536
N-ethyl-1-(4-methylquinolin-2-yl)ethanamine
CID 114755257
2-(2-fluorophenyl)-1-pyrimidin-4-ylethanol
CID 63987868
(2-ethylpyrazol-3-yl)-(4-methylquinolin-2-yl)methanol
CID 114754847

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenyl)-1-(4-methylquinolin-2-yl)ethanol?
The IUPAC name of 2-(2-fluorophenyl)-1-(4-methylquinolin-2-yl)ethanol (CID 114754909) is 2-(2-fluorophenyl)-1-(4-methylquinolin-2-yl)ethanol.
What is the SMILES notation for 2-(2-fluorophenyl)-1-(4-methylquinolin-2-yl)ethanol?
The canonical SMILES for 2-(2-fluorophenyl)-1-(4-methylquinolin-2-yl)ethanol is Cc1cc(C(O)Cc2ccccc2F)nc2ccccc12.
What is the InChIKey of 2-(2-fluorophenyl)-1-(4-methylquinolin-2-yl)ethanol?
The InChIKey is ISVOBZDHGWVMNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16FNO/c1-12-10-17(20-16-9-5-3-7-14(12)16)18(21)11-13-6-2-4-8-15(13)19/h2-10,18,21H,11H2,1H3.
What are the key properties of 2-(2-fluorophenyl)-1-(4-methylquinolin-2-yl)ethanol?
2-(2-fluorophenyl)-1-(4-methylquinolin-2-yl)ethanol has a molecular weight of 281.33 g/mol, XLogP of 3.96, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)-1-(4-methylquinolin-2-yl)ethanol is sourced from PubChem (CID 114754909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).