1-(2,5-dimethoxyphenyl)-2-(2,5-dimethylphenyl)ethanol

C18H22O3 — CID 62537711

IUPAC1-(2,5-dimethoxyphenyl)-2-(2,5-dimethylphenyl)ethanol
SMILESCOc1ccc(OC)c(C(O)Cc2cc(C)ccc2C)c1
InChIInChI=1S/C18H22O3/c1-12-5-6-13(2)14(9-12)10-17(19)16-11-15(20-3)7-8-18(16)21-4/h5-9,11,17,19H,10H2,1-4H3
InChIKeyICNQMOSSDYMSRY-UHFFFAOYSA-N
MW286.37 g/mol
LogP3.60
Rot. Bonds5

About 1-(2,5-dimethoxyphenyl)-2-(2,5-dimethylphenyl)ethanol

1-(2,5-dimethoxyphenyl)-2-(2,5-dimethylphenyl)ethanol (PubChem CID 62537711) has the molecular formula C18H22O3 and a molecular weight of 286.37 g/mol. Its IUPAC name is 1-(2,5-dimethoxyphenyl)-2-(2,5-dimethylphenyl)ethanol.

Molecular Properties

Compound Name1-(2,5-dimethoxyphenyl)-2-(2,5-dimethylphenyl)ethanol
PubChem CID62537711
Molecular FormulaC18H22O3
Molecular Weight286.37 g/mol
Exact Mass286.16
IUPAC Name1-(2,5-dimethoxyphenyl)-2-(2,5-dimethylphenyl)ethanol
SMILESCOc1ccc(OC)c(C(O)Cc2cc(C)ccc2C)c1
InChIInChI=1S/C18H22O3/c1-12-5-6-13(2)14(9-12)10-17(19)16-11-15(20-3)7-8-18(16)21-4/h5-9,11,17,19H,10H2,1-4H3
InChIKeyICNQMOSSDYMSRY-UHFFFAOYSA-N
XLogP3.60
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.37
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2,5-dimethoxyphenyl)-2-(2-methylphenyl)ethanol
CID 61100911
2-[2-chloro-2-(2,5-dimethoxyphenyl)ethyl]-1,4-dimethylbenzene
CID 63429457
1,2-bis(2-methoxy-5-methylphenyl)ethanol
CID 115781516
2-(2,5-dimethylphenyl)-1-(3-methoxy-4-methylphenyl)ethanol
CID 63018668
1-(5-bromo-2-methoxyphenyl)-2-(2-methoxy-5-methylphenyl)ethanol
CID 63894596
(1R)-1-(2,5-dimethoxyphenyl)ethane-1,2-diol
CID 51666215
[2-(2,5-dimethoxyphenyl)-2-hydroxyethyl]azanium
CID 23238192
1-(2-aminophenyl)-2-(2-methoxy-5-methylphenyl)ethanol
CID 64833173
(1S)-1-(2,5-dimethoxyphenyl)-2-[4-(2,5-dimethylphenyl)piperazin-1-yl]ethanol
CID 52905693
1-[1-bromo-2-(2,5-dimethylphenyl)ethyl]-2-chloro-4-methoxybenzene
CID 63443786
2-(2,5-dimethylphenyl)-1-naphthalen-1-ylethanol
CID 63411264
(2R)-1-(5-methoxy-2-methylphenyl)propan-2-ol
CID 68649923

Frequently Asked Questions

What is the IUPAC name of 1-(2,5-dimethoxyphenyl)-2-(2,5-dimethylphenyl)ethanol?
The IUPAC name of 1-(2,5-dimethoxyphenyl)-2-(2,5-dimethylphenyl)ethanol (CID 62537711) is 1-(2,5-dimethoxyphenyl)-2-(2,5-dimethylphenyl)ethanol.
What is the SMILES notation for 1-(2,5-dimethoxyphenyl)-2-(2,5-dimethylphenyl)ethanol?
The canonical SMILES for 1-(2,5-dimethoxyphenyl)-2-(2,5-dimethylphenyl)ethanol is COc1ccc(OC)c(C(O)Cc2cc(C)ccc2C)c1.
What is the InChIKey of 1-(2,5-dimethoxyphenyl)-2-(2,5-dimethylphenyl)ethanol?
The InChIKey is ICNQMOSSDYMSRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22O3/c1-12-5-6-13(2)14(9-12)10-17(19)16-11-15(20-3)7-8-18(16)21-4/h5-9,11,17,19H,10H2,1-4H3.
What are the key properties of 1-(2,5-dimethoxyphenyl)-2-(2,5-dimethylphenyl)ethanol?
1-(2,5-dimethoxyphenyl)-2-(2,5-dimethylphenyl)ethanol has a molecular weight of 286.37 g/mol, XLogP of 3.60, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-dimethoxyphenyl)-2-(2,5-dimethylphenyl)ethanol is sourced from PubChem (CID 62537711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).