2,4-dimethoxy-1-[2-(4-methylphenyl)prop-1-enyl]benzene

C18H20O2 — CID 59073216

IUPAC2,4-dimethoxy-1-[2-(4-methylphenyl)prop-1-enyl]benzene
SMILESCOc1ccc(C=C(C)c2ccc(C)cc2)c(OC)c1
InChIInChI=1S/C18H20O2/c1-13-5-7-15(8-6-13)14(2)11-16-9-10-17(19-3)12-18(16)20-4/h5-12H,1-4H3
InChIKeyDVQBFRUXAOBXQH-UHFFFAOYSA-N
MW268.36 g/mol
LogP4.57
Rot. Bonds4

About 2,4-dimethoxy-1-[2-(4-methylphenyl)prop-1-enyl]benzene

2,4-dimethoxy-1-[2-(4-methylphenyl)prop-1-enyl]benzene (PubChem CID 59073216) has the molecular formula C18H20O2 and a molecular weight of 268.36 g/mol. Its IUPAC name is 2,4-dimethoxy-1-[2-(4-methylphenyl)prop-1-enyl]benzene.

Molecular Properties

Compound Name2,4-dimethoxy-1-[2-(4-methylphenyl)prop-1-enyl]benzene
PubChem CID59073216
Molecular FormulaC18H20O2
Molecular Weight268.36 g/mol
Exact Mass268.15
IUPAC Name2,4-dimethoxy-1-[2-(4-methylphenyl)prop-1-enyl]benzene
SMILESCOc1ccc(C=C(C)c2ccc(C)cc2)c(OC)c1
InChIInChI=1S/C18H20O2/c1-13-5-7-15(8-6-13)14(2)11-16-9-10-17(19-3)12-18(16)20-4/h5-12H,1-4H3
InChIKeyDVQBFRUXAOBXQH-UHFFFAOYSA-N
XLogP4.57
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 54.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(Z)-2-[4-[(Z)-1-cyano-2-(2,4-dimethoxyphenyl)ethenyl]phenyl]-3-(2,4-dimethoxyphenyl)prop-2-enenitrile
CID 6005345
(E)-2-bromo-3-(2,4-dimethoxyphenyl)prop-2-enal
CID 143192374
1-(3-bromo-2-methylprop-1-enyl)-2,4-dimethoxybenzene
CID 79322600
[4-[3-(2,4-dimethoxyphenyl)prop-2-enoyl]phenyl] 4-methylbenzoate
CID 3526790
2,4-dimethoxy-1-[(Z)-2-nitroprop-1-enyl]benzene
CID 5374508
2-[(E)-1-(4-fluorophenyl)-2-[4-[(Z)-2-(4-fluorophenyl)prop-1-enyl]-2,5-dimethoxyphenyl]ethenyl]-6-methylnaphthalene
CID 59972363
1,4-dimethoxy-2-methyl-5-[(E)-2-phenylprop-1-enyl]benzene
CID 10707027
(Z)-3-(2,4-dimethoxyphenyl)-2-(4-hydroxyphenyl)prop-2-enoic acid
CID 83955645
2-(4-bromophenyl)-3-(2,4-dimethoxyphenyl)prop-2-enenitrile
CID 2992626
3-(2,4-dimethoxyphenyl)-2-methyl-1-(4-prop-2-enoxyphenyl)prop-2-en-1-one
CID 54173352
(E)-3-(4-methoxy-2-methylphenyl)-2-(4-methylphenyl)prop-2-enenitrile
CID 21374798
2-[(2,4-dimethoxyphenyl)methylidene]-3-methylbutanal
CID 79016965

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethoxy-1-[2-(4-methylphenyl)prop-1-enyl]benzene?
The IUPAC name of 2,4-dimethoxy-1-[2-(4-methylphenyl)prop-1-enyl]benzene (CID 59073216) is 2,4-dimethoxy-1-[2-(4-methylphenyl)prop-1-enyl]benzene.
What is the SMILES notation for 2,4-dimethoxy-1-[2-(4-methylphenyl)prop-1-enyl]benzene?
The canonical SMILES for 2,4-dimethoxy-1-[2-(4-methylphenyl)prop-1-enyl]benzene is COc1ccc(C=C(C)c2ccc(C)cc2)c(OC)c1.
What is the InChIKey of 2,4-dimethoxy-1-[2-(4-methylphenyl)prop-1-enyl]benzene?
The InChIKey is DVQBFRUXAOBXQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20O2/c1-13-5-7-15(8-6-13)14(2)11-16-9-10-17(19-3)12-18(16)20-4/h5-12H,1-4H3.
What are the key properties of 2,4-dimethoxy-1-[2-(4-methylphenyl)prop-1-enyl]benzene?
2,4-dimethoxy-1-[2-(4-methylphenyl)prop-1-enyl]benzene has a molecular weight of 268.36 g/mol, XLogP of 4.57, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethoxy-1-[2-(4-methylphenyl)prop-1-enyl]benzene is sourced from PubChem (CID 59073216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).