2-benzyl-4-methoxy-3-methylphenol

C15H16O2 — CID 70517924

IUPAC2-benzyl-4-methoxy-3-methylphenol
SMILESCOc1ccc(O)c(Cc2ccccc2)c1C
InChIInChI=1S/C15H16O2/c1-11-13(10-12-6-4-3-5-7-12)14(16)8-9-15(11)17-2/h3-9,16H,10H2,1-2H3
InChIKeyOTQZRNIBOYOGHI-UHFFFAOYSA-N
MW228.29 g/mol
LogP3.30
Rot. Bonds3

About 2-benzyl-4-methoxy-3-methylphenol

2-benzyl-4-methoxy-3-methylphenol (PubChem CID 70517924) has the molecular formula C15H16O2 and a molecular weight of 228.29 g/mol. Its IUPAC name is 2-benzyl-4-methoxy-3-methylphenol.

Molecular Properties

Compound Name2-benzyl-4-methoxy-3-methylphenol
PubChem CID70517924
Molecular FormulaC15H16O2
Molecular Weight228.29 g/mol
Exact Mass228.12
IUPAC Name2-benzyl-4-methoxy-3-methylphenol
SMILESCOc1ccc(O)c(Cc2ccccc2)c1C
InChIInChI=1S/C15H16O2/c1-11-13(10-12-6-4-3-5-7-12)14(16)8-9-15(11)17-2/h3-9,16H,10H2,1-2H3
InChIKeyOTQZRNIBOYOGHI-UHFFFAOYSA-N
XLogP3.30
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 ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3-benzyl-2,4-dimethoxyphenyl)ethanone
CID 14523506
3-methoxy-2-(2-phenylethyl)phenol
CID 44887037
2-benzyl-1,3-dimethoxy-5-phenylbenzene
CID 16741983
2-methoxy-4-(3-methyl-4-phenylmethoxyphenyl)phenol
CID 145389555
3-benzyl-1,2-dibutyl-4-methoxybenzene
CID 70537049
(5-benzyl-2-methoxyphenyl)methanediol
CID 70401164
2-bromo-3-methyl-4-phenylmethoxyphenol
CID 150350676
4,5-dimethoxy-6-phenylmethoxynaphthalen-1-ol
CID 13468257
2-bromo-4-methoxy-3-methylphenol
CID 54571766
1,5-dibenzyl-2,4-dimethoxybenzene
CID 134865682
1-(5-benzyl-2-methoxyphenyl)ethanone
CID 10681517
azane;4-benzyl-1,2-dimethoxybenzene
CID 69220644

Frequently Asked Questions

What is the IUPAC name of 2-benzyl-4-methoxy-3-methylphenol?
The IUPAC name of 2-benzyl-4-methoxy-3-methylphenol (CID 70517924) is 2-benzyl-4-methoxy-3-methylphenol.
What is the SMILES notation for 2-benzyl-4-methoxy-3-methylphenol?
The canonical SMILES for 2-benzyl-4-methoxy-3-methylphenol is COc1ccc(O)c(Cc2ccccc2)c1C.
What is the InChIKey of 2-benzyl-4-methoxy-3-methylphenol?
The InChIKey is OTQZRNIBOYOGHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16O2/c1-11-13(10-12-6-4-3-5-7-12)14(16)8-9-15(11)17-2/h3-9,16H,10H2,1-2H3.
What are the key properties of 2-benzyl-4-methoxy-3-methylphenol?
2-benzyl-4-methoxy-3-methylphenol has a molecular weight of 228.29 g/mol, XLogP of 3.30, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzyl-4-methoxy-3-methylphenol is sourced from PubChem (CID 70517924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).