1-(5-chloroquinolin-8-yl)-2-phenylethanol

C17H14ClNO — CID 112618238

IUPAC1-(5-chloroquinolin-8-yl)-2-phenylethanol
SMILESOC(Cc1ccccc1)c1ccc(Cl)c2cccnc12
InChIInChI=1S/C17H14ClNO/c18-15-9-8-14(17-13(15)7-4-10-19-17)16(20)11-12-5-2-1-3-6-12/h1-10,16,20H,11H2
InChIKeyUCYNVGYNXCIBMC-UHFFFAOYSA-N
MW283.76 g/mol
LogP4.16
Rot. Bonds3

About 1-(5-chloroquinolin-8-yl)-2-phenylethanol

1-(5-chloroquinolin-8-yl)-2-phenylethanol (PubChem CID 112618238) has the molecular formula C17H14ClNO and a molecular weight of 283.76 g/mol. Its IUPAC name is 1-(5-chloroquinolin-8-yl)-2-phenylethanol.

Molecular Properties

Compound Name1-(5-chloroquinolin-8-yl)-2-phenylethanol
PubChem CID112618238
Molecular FormulaC17H14ClNO
Molecular Weight283.76 g/mol
Exact Mass283.08
IUPAC Name1-(5-chloroquinolin-8-yl)-2-phenylethanol
SMILESOC(Cc1ccccc1)c1ccc(Cl)c2cccnc12
InChIInChI=1S/C17H14ClNO/c18-15-9-8-14(17-13(15)7-4-10-19-17)16(20)11-12-5-2-1-3-6-12/h1-10,16,20H,11H2
InChIKeyUCYNVGYNXCIBMC-UHFFFAOYSA-N
XLogP4.16
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.76
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-chlorophenyl)-1-(5-chloroquinolin-8-yl)ethanol
CID 115960037
1-(5-chloroquinolin-8-yl)-2-(4,5-dimethyl-1,3-thiazol-2-yl)ethanol
CID 115960088
1-(5-chloroquinolin-8-yl)-2,2-difluoroethanol
CID 112618208
2-(3,4-dichlorophenyl)-1-quinolin-8-ylethanol
CID 65148875
ethyl 4-(5-chloroquinolin-8-yl)-4-hydroxybutanoate
CID 115960222
(2-chloro-5-fluorophenyl)-(5-chloroquinolin-8-yl)methanol
CID 105394021
(5-chloroquinolin-8-yl)-(3-methyltriazol-4-yl)methanol
CID 114685420
4-amino-3-(5-chloroquinolin-8-yl)pentanoic acid
CID 112618653
[1-(5-chloro-8-hydroxyquinolin-7-yl)-2-phenylethyl]carbamic acid
CID 69307133
1-(4-chlorophenyl)-3-[(5-chloroquinolin-8-yl)methylamino]propan-2-ol
CID 167757522
(4-chloro-1-ethylpyrazol-5-yl)-(5-chloroquinolin-8-yl)methanol
CID 114638079
methyl 3-(5-chloroquinolin-8-yl)-3-hydroxy-2-methylpropanoate
CID 112618441

Frequently Asked Questions

What is the IUPAC name of 1-(5-chloroquinolin-8-yl)-2-phenylethanol?
The IUPAC name of 1-(5-chloroquinolin-8-yl)-2-phenylethanol (CID 112618238) is 1-(5-chloroquinolin-8-yl)-2-phenylethanol.
What is the SMILES notation for 1-(5-chloroquinolin-8-yl)-2-phenylethanol?
The canonical SMILES for 1-(5-chloroquinolin-8-yl)-2-phenylethanol is OC(Cc1ccccc1)c1ccc(Cl)c2cccnc12.
What is the InChIKey of 1-(5-chloroquinolin-8-yl)-2-phenylethanol?
The InChIKey is UCYNVGYNXCIBMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14ClNO/c18-15-9-8-14(17-13(15)7-4-10-19-17)16(20)11-12-5-2-1-3-6-12/h1-10,16,20H,11H2.
What are the key properties of 1-(5-chloroquinolin-8-yl)-2-phenylethanol?
1-(5-chloroquinolin-8-yl)-2-phenylethanol has a molecular weight of 283.76 g/mol, XLogP of 4.16, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-chloroquinolin-8-yl)-2-phenylethanol is sourced from PubChem (CID 112618238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).