2-[4-(2-methylquinolin-4-yl)oxyphenyl]ethanol

C18H17NO2 — CID 107709613

IUPAC2-[4-(2-methylquinolin-4-yl)oxyphenyl]ethanol
SMILESCc1cc(Oc2ccc(CCO)cc2)c2ccccc2n1
InChIInChI=1S/C18H17NO2/c1-13-12-18(16-4-2-3-5-17(16)19-13)21-15-8-6-14(7-9-15)10-11-20/h2-9,12,20H,10-11H2,1H3
InChIKeyRIBDHBRTLSOEJB-UHFFFAOYSA-N
MW279.34 g/mol
LogP3.87
Rot. Bonds4

About 2-[4-(2-methylquinolin-4-yl)oxyphenyl]ethanol

2-[4-(2-methylquinolin-4-yl)oxyphenyl]ethanol (PubChem CID 107709613) has the molecular formula C18H17NO2 and a molecular weight of 279.34 g/mol. Its IUPAC name is 2-[4-(2-methylquinolin-4-yl)oxyphenyl]ethanol.

Molecular Properties

Compound Name2-[4-(2-methylquinolin-4-yl)oxyphenyl]ethanol
PubChem CID107709613
Molecular FormulaC18H17NO2
Molecular Weight279.34 g/mol
Exact Mass279.13
IUPAC Name2-[4-(2-methylquinolin-4-yl)oxyphenyl]ethanol
SMILESCc1cc(Oc2ccc(CCO)cc2)c2ccccc2n1
InChIInChI=1S/C18H17NO2/c1-13-12-18(16-4-2-3-5-17(16)19-13)21-15-8-6-14(7-9-15)10-11-20/h2-9,12,20H,10-11H2,1H3
InChIKeyRIBDHBRTLSOEJB-UHFFFAOYSA-N
XLogP3.87
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.34
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[3-(2-methylquinolin-4-yl)oxyphenyl]methanol
CID 79869243
3-(2-methylquinolin-4-yl)oxyphenol
CID 60871458
2-(2-methylquinolin-4-yl)oxybenzoic acid
CID 61395430
2-[4-(2-hydroxyethyl)phenoxy]-6-methylpyrimidine-4-carboxylic acid
CID 107710034
2-(2-methylquinolin-4-yl)oxyacetic acid
CID 658584
2-[4-[(2-methylquinolin-4-yl)oxymethyl]phenoxy]-2-phenylacetic acid
CID 22407414
[4-[[3-(aminomethyl)-2,6-dimethyl-4-pyridinyl]oxy]phenyl]methanol
CID 81051272
2-(4-phthalazin-1-yloxyphenyl)ethanol
CID 107709669
[4-(3-methylphenoxy)quinolin-2-yl]methanol
CID 63376019
3-(2-methylquinolin-4-yl)oxypropan-1-amine
CID 62349241
2-[4-(2-hydroxyethyl)phenoxy]-6-methylpyridine-4-carboxamide
CID 107709693
2-[4-(2-hydroxyethyl)phenoxy]-4-methylbenzoic acid
CID 107708690

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-methylquinolin-4-yl)oxyphenyl]ethanol?
The IUPAC name of 2-[4-(2-methylquinolin-4-yl)oxyphenyl]ethanol (CID 107709613) is 2-[4-(2-methylquinolin-4-yl)oxyphenyl]ethanol.
What is the SMILES notation for 2-[4-(2-methylquinolin-4-yl)oxyphenyl]ethanol?
The canonical SMILES for 2-[4-(2-methylquinolin-4-yl)oxyphenyl]ethanol is Cc1cc(Oc2ccc(CCO)cc2)c2ccccc2n1.
What is the InChIKey of 2-[4-(2-methylquinolin-4-yl)oxyphenyl]ethanol?
The InChIKey is RIBDHBRTLSOEJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17NO2/c1-13-12-18(16-4-2-3-5-17(16)19-13)21-15-8-6-14(7-9-15)10-11-20/h2-9,12,20H,10-11H2,1H3.
What are the key properties of 2-[4-(2-methylquinolin-4-yl)oxyphenyl]ethanol?
2-[4-(2-methylquinolin-4-yl)oxyphenyl]ethanol has a molecular weight of 279.34 g/mol, XLogP of 3.87, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-methylquinolin-4-yl)oxyphenyl]ethanol is sourced from PubChem (CID 107709613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).