3-(4-ethylphenyl)-5-methoxyphenol

C15H16O2 — CID 53220748

IUPAC3-(4-ethylphenyl)-5-methoxyphenol
SMILESCCc1ccc(-c2cc(O)cc(OC)c2)cc1
InChIInChI=1S/C15H16O2/c1-3-11-4-6-12(7-5-11)13-8-14(16)10-15(9-13)17-2/h4-10,16H,3H2,1-2H3
InChIKeyPWCMAPYIOJHPJA-UHFFFAOYSA-N
MW228.29 g/mol
LogP3.63
Rot. Bonds3

About 3-(4-ethylphenyl)-5-methoxyphenol

3-(4-ethylphenyl)-5-methoxyphenol (PubChem CID 53220748) has the molecular formula C15H16O2 and a molecular weight of 228.29 g/mol. Its IUPAC name is 3-(4-ethylphenyl)-5-methoxyphenol.

Molecular Properties

Compound Name3-(4-ethylphenyl)-5-methoxyphenol
PubChem CID53220748
Molecular FormulaC15H16O2
Molecular Weight228.29 g/mol
Exact Mass228.12
IUPAC Name3-(4-ethylphenyl)-5-methoxyphenol
SMILESCCc1ccc(-c2cc(O)cc(OC)c2)cc1
InChIInChI=1S/C15H16O2/c1-3-11-4-6-12(7-5-11)13-8-14(16)10-15(9-13)17-2/h4-10,16H,3H2,1-2H3
InChIKeyPWCMAPYIOJHPJA-UHFFFAOYSA-N
XLogP3.63
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(4-ethylphenyl)-5-methoxyphenol?
The IUPAC name of 3-(4-ethylphenyl)-5-methoxyphenol (CID 53220748) is 3-(4-ethylphenyl)-5-methoxyphenol.
What is the SMILES notation for 3-(4-ethylphenyl)-5-methoxyphenol?
The canonical SMILES for 3-(4-ethylphenyl)-5-methoxyphenol is CCc1ccc(-c2cc(O)cc(OC)c2)cc1.
What is the InChIKey of 3-(4-ethylphenyl)-5-methoxyphenol?
The InChIKey is PWCMAPYIOJHPJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16O2/c1-3-11-4-6-12(7-5-11)13-8-14(16)10-15(9-13)17-2/h4-10,16H,3H2,1-2H3.
What are the key properties of 3-(4-ethylphenyl)-5-methoxyphenol?
3-(4-ethylphenyl)-5-methoxyphenol has a molecular weight of 228.29 g/mol, XLogP of 3.63, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-ethylphenyl)-5-methoxyphenol is sourced from PubChem (CID 53220748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).