2-(2-hydroxy-4-methyl-5-propylphenyl)-6-methoxy-4-methylphenol

C18H22O3 — CID 118644032

IUPAC2-(2-hydroxy-4-methyl-5-propylphenyl)-6-methoxy-4-methylphenol
SMILESCCCc1cc(-c2cc(C)cc(OC)c2O)c(O)cc1C
InChIInChI=1S/C18H22O3/c1-5-6-13-10-14(16(19)9-12(13)3)15-7-11(2)8-17(21-4)18(15)20/h7-10,19-20H,5-6H2,1-4H3
InChIKeySBRSXSKJODUWRN-UHFFFAOYSA-N
MW286.37 g/mol
LogP4.34
Rot. Bonds4

About 2-(2-hydroxy-4-methyl-5-propylphenyl)-6-methoxy-4-methylphenol

2-(2-hydroxy-4-methyl-5-propylphenyl)-6-methoxy-4-methylphenol (PubChem CID 118644032) has the molecular formula C18H22O3 and a molecular weight of 286.37 g/mol. Its IUPAC name is 2-(2-hydroxy-4-methyl-5-propylphenyl)-6-methoxy-4-methylphenol.

Molecular Properties

Compound Name2-(2-hydroxy-4-methyl-5-propylphenyl)-6-methoxy-4-methylphenol
PubChem CID118644032
Molecular FormulaC18H22O3
Molecular Weight286.37 g/mol
Exact Mass286.16
IUPAC Name2-(2-hydroxy-4-methyl-5-propylphenyl)-6-methoxy-4-methylphenol
SMILESCCCc1cc(-c2cc(C)cc(OC)c2O)c(O)cc1C
InChIInChI=1S/C18H22O3/c1-5-6-13-10-14(16(19)9-12(13)3)15-7-11(2)8-17(21-4)18(15)20/h7-10,19-20H,5-6H2,1-4H3
InChIKeySBRSXSKJODUWRN-UHFFFAOYSA-N
XLogP4.34
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.37
LogP ≤ 54.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-hydroxy-4,5-dimethylphenyl)-4-methyl-6-sulfanyloxyphenol
CID 129015641
2-ethyl-6-methoxy-4-methylphenol
CID 23597037
2-[2-hydroxy-4-(2-sulfanylpropan-2-yl)phenyl]-6-methoxy-4-methylphenol
CID 129016729
ethane;2-methoxy-6-propylphenol
CID 142869062
2-ethoxy-6-methoxy-4-methylphenol
CID 125485812
2-methoxy-5-propylbenzene-1,4-diol
CID 5314475
5-methoxy-2-propylphenol
CID 12836519
2-methoxy-3,4-bis(4-methylphenyl)-6-propylphenol
CID 57154102
6-methoxy-3-methyl-2-propylphenol
CID 170766303
1-methyl-4-[4-(4-methylphenyl)phenyl]-2,5-dipropylbenzene
CID 59821643
2,4-dimethoxy-1,3-bis(4-methoxy-3-methylphenyl)-5-propylbenzene
CID 173310858
ethyl 2-amino-3-(2-hydroxy-3-methoxy-5-methylphenyl)propanoate
CID 170885808

Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxy-4-methyl-5-propylphenyl)-6-methoxy-4-methylphenol?
The IUPAC name of 2-(2-hydroxy-4-methyl-5-propylphenyl)-6-methoxy-4-methylphenol (CID 118644032) is 2-(2-hydroxy-4-methyl-5-propylphenyl)-6-methoxy-4-methylphenol.
What is the SMILES notation for 2-(2-hydroxy-4-methyl-5-propylphenyl)-6-methoxy-4-methylphenol?
The canonical SMILES for 2-(2-hydroxy-4-methyl-5-propylphenyl)-6-methoxy-4-methylphenol is CCCc1cc(-c2cc(C)cc(OC)c2O)c(O)cc1C.
What is the InChIKey of 2-(2-hydroxy-4-methyl-5-propylphenyl)-6-methoxy-4-methylphenol?
The InChIKey is SBRSXSKJODUWRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22O3/c1-5-6-13-10-14(16(19)9-12(13)3)15-7-11(2)8-17(21-4)18(15)20/h7-10,19-20H,5-6H2,1-4H3.
What are the key properties of 2-(2-hydroxy-4-methyl-5-propylphenyl)-6-methoxy-4-methylphenol?
2-(2-hydroxy-4-methyl-5-propylphenyl)-6-methoxy-4-methylphenol has a molecular weight of 286.37 g/mol, XLogP of 4.34, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxy-4-methyl-5-propylphenyl)-6-methoxy-4-methylphenol is sourced from PubChem (CID 118644032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).