1-(3-methoxyphenyl)-1-quinolin-3-ylethanol

C18H17NO2 — CID 60924847

IUPAC1-(3-methoxyphenyl)-1-quinolin-3-ylethanol
SMILESCOc1cccc(C(C)(O)c2cnc3ccccc3c2)c1
InChIInChI=1S/C18H17NO2/c1-18(20,14-7-5-8-16(11-14)21-2)15-10-13-6-3-4-9-17(13)19-12-15/h3-12,20H,1-2H3
InChIKeyIEOYMFOCNKQOFP-UHFFFAOYSA-N
MW279.34 g/mol
LogP3.50
Rot. Bonds3

About 1-(3-methoxyphenyl)-1-quinolin-3-ylethanol

1-(3-methoxyphenyl)-1-quinolin-3-ylethanol (PubChem CID 60924847) has the molecular formula C18H17NO2 and a molecular weight of 279.34 g/mol. Its IUPAC name is 1-(3-methoxyphenyl)-1-quinolin-3-ylethanol.

Molecular Properties

Compound Name1-(3-methoxyphenyl)-1-quinolin-3-ylethanol
PubChem CID60924847
Molecular FormulaC18H17NO2
Molecular Weight279.34 g/mol
Exact Mass279.13
IUPAC Name1-(3-methoxyphenyl)-1-quinolin-3-ylethanol
SMILESCOc1cccc(C(C)(O)c2cnc3ccccc3c2)c1
InChIInChI=1S/C18H17NO2/c1-18(20,14-7-5-8-16(11-14)21-2)15-10-13-6-3-4-9-17(13)19-12-15/h3-12,20H,1-2H3
InChIKeyIEOYMFOCNKQOFP-UHFFFAOYSA-N
XLogP3.50
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.34
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-methoxyphenyl)-1-naphthalen-2-ylethanol
CID 62787792
1-(3-methoxyphenyl)-1-phenylethanol
CID 15680503
(1S)-1-(3-methoxyphenyl)-1-phenylethanol
CID 29415940
1-(2-methoxyphenyl)-1-quinolin-3-ylethanol
CID 60924956
1-quinolin-3-yl-1-thiophen-2-ylethanol
CID 55163309
1-(3,4-dimethoxyphenyl)-1-(3-methoxyphenyl)ethanol
CID 62787623
(2S,3S)-2,3-bis(3-methoxyphenyl)butane-2,3-diol
CID 101270093
(3-methoxyphenyl)-quinolin-3-ylmethanol
CID 60924189
1-fluoro-1-(3-methoxyphenyl)ethanol
CID 174577353
(3-methoxyphenyl)-dipyridin-2-ylmethanol;dihydrochloride
CID 90485685
methyl 4-[1-hydroxy-1-(3-methoxyphenyl)ethyl]benzoate
CID 22408189
(2S)-1,1,1-trifluoro-2-(3-methoxyphenyl)propan-2-ol
CID 166750619

Frequently Asked Questions

What is the IUPAC name of 1-(3-methoxyphenyl)-1-quinolin-3-ylethanol?
The IUPAC name of 1-(3-methoxyphenyl)-1-quinolin-3-ylethanol (CID 60924847) is 1-(3-methoxyphenyl)-1-quinolin-3-ylethanol.
What is the SMILES notation for 1-(3-methoxyphenyl)-1-quinolin-3-ylethanol?
The canonical SMILES for 1-(3-methoxyphenyl)-1-quinolin-3-ylethanol is COc1cccc(C(C)(O)c2cnc3ccccc3c2)c1.
What is the InChIKey of 1-(3-methoxyphenyl)-1-quinolin-3-ylethanol?
The InChIKey is IEOYMFOCNKQOFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17NO2/c1-18(20,14-7-5-8-16(11-14)21-2)15-10-13-6-3-4-9-17(13)19-12-15/h3-12,20H,1-2H3.
What are the key properties of 1-(3-methoxyphenyl)-1-quinolin-3-ylethanol?
1-(3-methoxyphenyl)-1-quinolin-3-ylethanol has a molecular weight of 279.34 g/mol, XLogP of 3.50, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methoxyphenyl)-1-quinolin-3-ylethanol is sourced from PubChem (CID 60924847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).