1-(2-methoxyphenyl)-2-(4-propylphenoxy)ethanol

C18H22O3 — CID 62549968

IUPAC1-(2-methoxyphenyl)-2-(4-propylphenoxy)ethanol
SMILESCCCc1ccc(OCC(O)c2ccccc2OC)cc1
InChIInChI=1S/C18H22O3/c1-3-6-14-9-11-15(12-10-14)21-13-17(19)16-7-4-5-8-18(16)20-2/h4-5,7-12,17,19H,3,6,13H2,1-2H3
InChIKeyRVBCRWMCUYLPBA-UHFFFAOYSA-N
MW286.37 g/mol
LogP3.76
Rot. Bonds7

About 1-(2-methoxyphenyl)-2-(4-propylphenoxy)ethanol

1-(2-methoxyphenyl)-2-(4-propylphenoxy)ethanol (PubChem CID 62549968) has the molecular formula C18H22O3 and a molecular weight of 286.37 g/mol. Its IUPAC name is 1-(2-methoxyphenyl)-2-(4-propylphenoxy)ethanol.

Molecular Properties

Compound Name1-(2-methoxyphenyl)-2-(4-propylphenoxy)ethanol
PubChem CID62549968
Molecular FormulaC18H22O3
Molecular Weight286.37 g/mol
Exact Mass286.16
IUPAC Name1-(2-methoxyphenyl)-2-(4-propylphenoxy)ethanol
SMILESCCCc1ccc(OCC(O)c2ccccc2OC)cc1
InChIInChI=1S/C18H22O3/c1-3-6-14-9-11-15(12-10-14)21-13-17(19)16-7-4-5-8-18(16)20-2/h4-5,7-12,17,19H,3,6,13H2,1-2H3
InChIKeyRVBCRWMCUYLPBA-UHFFFAOYSA-N
XLogP3.76
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.37
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-phenoxy-1-(4-propylphenyl)ethanol
CID 54943234
2-(4-chlorophenoxy)-1-(2-ethoxyphenyl)ethanol
CID 105095796
2-[2-(4-ethylphenoxy)-1-hydroxyethyl]phenol
CID 71616839
2-(2,3-difluorophenoxy)-1-(2-methoxyphenyl)ethanol
CID 63038192
1-(5-chloro-2-methoxyphenyl)-2-phenoxyethanol
CID 62790142
2-[4-(2-methoxyethyl)phenoxy]-1-phenylethanol
CID 60730618
1-(2-aminophenyl)-2-(4-propoxyphenoxy)ethanol
CID 62269877
4-[4-[2-(2-fluorophenyl)-2-hydroxyethoxy]phenyl]butan-2-one
CID 110885738
1-(2-methoxyphenyl)-2-(4-methylphenyl)ethanol
CID 15638774
1-cyclopropyl-2-(4-propylphenoxy)ethanol
CID 63908083
1-(ethylamino)-3-(4-propylphenoxy)propan-2-ol
CID 62548727
(2,4-dimethoxyphenyl)-(4-propylphenyl)methanol
CID 61087943

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyphenyl)-2-(4-propylphenoxy)ethanol?
The IUPAC name of 1-(2-methoxyphenyl)-2-(4-propylphenoxy)ethanol (CID 62549968) is 1-(2-methoxyphenyl)-2-(4-propylphenoxy)ethanol.
What is the SMILES notation for 1-(2-methoxyphenyl)-2-(4-propylphenoxy)ethanol?
The canonical SMILES for 1-(2-methoxyphenyl)-2-(4-propylphenoxy)ethanol is CCCc1ccc(OCC(O)c2ccccc2OC)cc1.
What is the InChIKey of 1-(2-methoxyphenyl)-2-(4-propylphenoxy)ethanol?
The InChIKey is RVBCRWMCUYLPBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22O3/c1-3-6-14-9-11-15(12-10-14)21-13-17(19)16-7-4-5-8-18(16)20-2/h4-5,7-12,17,19H,3,6,13H2,1-2H3.
What are the key properties of 1-(2-methoxyphenyl)-2-(4-propylphenoxy)ethanol?
1-(2-methoxyphenyl)-2-(4-propylphenoxy)ethanol has a molecular weight of 286.37 g/mol, XLogP of 3.76, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyphenyl)-2-(4-propylphenoxy)ethanol is sourced from PubChem (CID 62549968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).