2-(3-methoxy-5-propan-2-ylphenyl)ethanol

C12H18O2 — CID 71373713

IUPAC2-(3-methoxy-5-propan-2-ylphenyl)ethanol
SMILESCOc1cc(CCO)cc(C(C)C)c1
InChIInChI=1S/C12H18O2/c1-9(2)11-6-10(4-5-13)7-12(8-11)14-3/h6-9,13H,4-5H2,1-3H3
InChIKeyKAUPNWSIRGFLTP-UHFFFAOYSA-N
MW194.27 g/mol
LogP2.35
Rot. Bonds4

About 2-(3-methoxy-5-propan-2-ylphenyl)ethanol

2-(3-methoxy-5-propan-2-ylphenyl)ethanol (PubChem CID 71373713) has the molecular formula C12H18O2 and a molecular weight of 194.27 g/mol. Its IUPAC name is 2-(3-methoxy-5-propan-2-ylphenyl)ethanol.

Molecular Properties

Compound Name2-(3-methoxy-5-propan-2-ylphenyl)ethanol
PubChem CID71373713
Molecular FormulaC12H18O2
Molecular Weight194.27 g/mol
Exact Mass194.13
IUPAC Name2-(3-methoxy-5-propan-2-ylphenyl)ethanol
SMILESCOc1cc(CCO)cc(C(C)C)c1
InChIInChI=1S/C12H18O2/c1-9(2)11-6-10(4-5-13)7-12(8-11)14-3/h6-9,13H,4-5H2,1-3H3
InChIKeyKAUPNWSIRGFLTP-UHFFFAOYSA-N
XLogP2.35
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.27
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3-methoxy-5-propan-2-ylphenyl)propan-2-amine
CID 117296829
2-[4-methoxy-3,5-di(propan-2-yl)phenyl]ethanol
CID 117345630
1-[2-(3,5-dimethoxyphenyl)ethyl]-3,5-dimethoxybenzene
CID 4670736
1-[(3-methoxy-5-propan-2-ylphenyl)methyl]piperazine
CID 117374507
[3-(hydroxymethyl)-5-propan-2-ylphenyl]methanol
CID 122692713
2-(3-fluoro-5-methoxy-4-propan-2-ylphenyl)ethanol
CID 117303138
2-amino-1-[3-methoxy-5-(methoxymethyl)phenyl]ethanol
CID 117301771
2-(3,5-dimethoxyphenyl)ethyl-trimethoxysilane
CID 59566880
3-(3-chloro-5-methoxyphenyl)propan-1-ol
CID 117289609
2-hydroxy-2-[3-methoxy-5-(3-oxopropyl)phenyl]acetic acid
CID 134657621
1-[2-(3-chlorophenyl)propyl]-3-[1-(3-methoxy-5-propan-2-ylphenyl)propan-2-yl]-5-methylbenzene
CID 137437964
methyl 2-hydroxy-2-(3-methoxy-5-propan-2-ylphenyl)acetate
CID 117349068

Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxy-5-propan-2-ylphenyl)ethanol?
The IUPAC name of 2-(3-methoxy-5-propan-2-ylphenyl)ethanol (CID 71373713) is 2-(3-methoxy-5-propan-2-ylphenyl)ethanol.
What is the SMILES notation for 2-(3-methoxy-5-propan-2-ylphenyl)ethanol?
The canonical SMILES for 2-(3-methoxy-5-propan-2-ylphenyl)ethanol is COc1cc(CCO)cc(C(C)C)c1.
What is the InChIKey of 2-(3-methoxy-5-propan-2-ylphenyl)ethanol?
The InChIKey is KAUPNWSIRGFLTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18O2/c1-9(2)11-6-10(4-5-13)7-12(8-11)14-3/h6-9,13H,4-5H2,1-3H3.
What are the key properties of 2-(3-methoxy-5-propan-2-ylphenyl)ethanol?
2-(3-methoxy-5-propan-2-ylphenyl)ethanol has a molecular weight of 194.27 g/mol, XLogP of 2.35, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxy-5-propan-2-ylphenyl)ethanol is sourced from PubChem (CID 71373713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).