5-[(Z)-2-(3-methoxy-4,5-dimethylphenyl)ethenyl]-2-methylphenol

C18H20O2 — CID 59149568

IUPAC5-[(Z)-2-(3-methoxy-4,5-dimethylphenyl)ethenyl]-2-methylphenol
SMILESCOc1cc(/C=C\c2ccc(C)c(O)c2)cc(C)c1C
InChIInChI=1S/C18H20O2/c1-12-5-6-15(10-17(12)19)7-8-16-9-13(2)14(3)18(11-16)20-4/h5-11,19H,1-4H3/b8-7-
InChIKeyPPORWELMPVKIFX-FPLPWBNLSA-N
MW268.36 g/mol
LogP4.50
Rot. Bonds3

About 5-[(Z)-2-(3-methoxy-4,5-dimethylphenyl)ethenyl]-2-methylphenol

5-[(Z)-2-(3-methoxy-4,5-dimethylphenyl)ethenyl]-2-methylphenol (PubChem CID 59149568) has the molecular formula C18H20O2 and a molecular weight of 268.36 g/mol. Its IUPAC name is 5-[(Z)-2-(3-methoxy-4,5-dimethylphenyl)ethenyl]-2-methylphenol.

Molecular Properties

Compound Name5-[(Z)-2-(3-methoxy-4,5-dimethylphenyl)ethenyl]-2-methylphenol
PubChem CID59149568
Molecular FormulaC18H20O2
Molecular Weight268.36 g/mol
Exact Mass268.15
IUPAC Name5-[(Z)-2-(3-methoxy-4,5-dimethylphenyl)ethenyl]-2-methylphenol
SMILESCOc1cc(/C=C\c2ccc(C)c(O)c2)cc(C)c1C
InChIInChI=1S/C18H20O2/c1-12-5-6-15(10-17(12)19)7-8-16-9-13(2)14(3)18(11-16)20-4/h5-11,19H,1-4H3/b8-7-
InChIKeyPPORWELMPVKIFX-FPLPWBNLSA-N
XLogP4.50
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 54.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'stilbene', 'substructure': 'N/A'}

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Related Compounds

[2-methoxy-5-[(Z)-2-(3-methoxy-4,5-dimethylphenyl)ethenyl]phenyl]azanium
CID 58281563
4-[2-(3,5-dimethoxy-4-methylphenyl)ethenyl]phenol
CID 152550506
5-[(Z)-2-(3,4-dimethoxyphenyl)ethenyl]-2,3-dimethoxyphenol
CID 5386528
5-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-2-fluorobenzene-1,3-diol
CID 72723769
2-methoxy-4-[(1E,4E)-5-(3-methoxy-4,5-dimethylphenyl)-3-methylidenepenta-1,4-dienyl]-6-methylphenol
CID 59180476
5-[(E)-2-(4-hydroxy-3-methylphenyl)ethenyl]-2-methylbenzene-1,3-diol
CID 101451865
4-[(E)-2-[3-[(E)-2-(4-hydroxy-3-methoxyphenyl)ethenyl]phenyl]ethenyl]-2-methoxyphenol
CID 11406193
4-[(Z)-2-(4-hydroxyphenyl)ethenyl]-2-methoxyphenol
CID 10377070
2,6-dimethoxy-4-[(E)-2-(4-methylphenyl)ethenyl]phenol
CID 101267278
2-methyl-5-[(E)-2-(3,4,5-trimethoxyphenyl)ethenyl]aniline
CID 19688317
4-[2-(4-hydroxy-3,5-dimethoxyphenyl)ethenyl]-2,6-dimethoxyphenol
CID 71361751
4-[(Z)-2-(4-methoxyphenyl)ethenyl]-1,2-dimethylbenzene
CID 10999067

Frequently Asked Questions

What is the IUPAC name of 5-[(Z)-2-(3-methoxy-4,5-dimethylphenyl)ethenyl]-2-methylphenol?
The IUPAC name of 5-[(Z)-2-(3-methoxy-4,5-dimethylphenyl)ethenyl]-2-methylphenol (CID 59149568) is 5-[(Z)-2-(3-methoxy-4,5-dimethylphenyl)ethenyl]-2-methylphenol.
What is the SMILES notation for 5-[(Z)-2-(3-methoxy-4,5-dimethylphenyl)ethenyl]-2-methylphenol?
The canonical SMILES for 5-[(Z)-2-(3-methoxy-4,5-dimethylphenyl)ethenyl]-2-methylphenol is COc1cc(/C=C\c2ccc(C)c(O)c2)cc(C)c1C.
What is the InChIKey of 5-[(Z)-2-(3-methoxy-4,5-dimethylphenyl)ethenyl]-2-methylphenol?
The InChIKey is PPORWELMPVKIFX-FPLPWBNLSA-N. The full InChI is InChI=1S/C18H20O2/c1-12-5-6-15(10-17(12)19)7-8-16-9-13(2)14(3)18(11-16)20-4/h5-11,19H,1-4H3/b8-7-.
What are the key properties of 5-[(Z)-2-(3-methoxy-4,5-dimethylphenyl)ethenyl]-2-methylphenol?
5-[(Z)-2-(3-methoxy-4,5-dimethylphenyl)ethenyl]-2-methylphenol has a molecular weight of 268.36 g/mol, XLogP of 4.50, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(Z)-2-(3-methoxy-4,5-dimethylphenyl)ethenyl]-2-methylphenol is sourced from PubChem (CID 59149568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).