1-methoxy-4-[(E)-3-(4-methoxyphenyl)prop-1-enyl]benzene

C17H18O2 — CID 10800947

IUPAC1-methoxy-4-[(E)-3-(4-methoxyphenyl)prop-1-enyl]benzene
SMILESCOc1ccc(/C=C/Cc2ccc(OC)cc2)cc1
InChIInChI=1S/C17H18O2/c1-18-16-10-6-14(7-11-16)4-3-5-15-8-12-17(19-2)13-9-15/h3-4,6-13H,5H2,1-2H3/b4-3+
InChIKeyPICCWFYLPLCYQJ-ONEGZZNKSA-N
MW254.33 g/mol
LogP3.96
Rot. Bonds5

About 1-methoxy-4-[(E)-3-(4-methoxyphenyl)prop-1-enyl]benzene

1-methoxy-4-[(E)-3-(4-methoxyphenyl)prop-1-enyl]benzene (PubChem CID 10800947) has the molecular formula C17H18O2 and a molecular weight of 254.33 g/mol. Its IUPAC name is 1-methoxy-4-[(E)-3-(4-methoxyphenyl)prop-1-enyl]benzene.

Molecular Properties

Compound Name1-methoxy-4-[(E)-3-(4-methoxyphenyl)prop-1-enyl]benzene
PubChem CID10800947
Molecular FormulaC17H18O2
Molecular Weight254.33 g/mol
Exact Mass254.13
IUPAC Name1-methoxy-4-[(E)-3-(4-methoxyphenyl)prop-1-enyl]benzene
SMILESCOc1ccc(/C=C/Cc2ccc(OC)cc2)cc1
InChIInChI=1S/C17H18O2/c1-18-16-10-6-14(7-11-16)4-3-5-15-8-12-17(19-2)13-9-15/h3-4,6-13H,5H2,1-2H3/b4-3+
InChIKeyPICCWFYLPLCYQJ-ONEGZZNKSA-N
XLogP3.96
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 53.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-bromo-4-[(E)-3-(4-methoxyphenyl)prop-1-enyl]benzene
CID 101485865
1-methoxy-4-[4-(4-methoxyphenyl)but-2-enyl]benzene
CID 54485845
1,2-dimethoxy-4-[(E)-3-(4-methoxyphenyl)prop-2-enyl]benzene
CID 46231236
1,2,3-trimethoxy-5-[3-(4-methoxyphenyl)prop-1-enyl]benzene
CID 141151486
1-methoxy-4-[2-[4-[2-[4-[2-(4-methoxyphenyl)ethenyl]phenyl]ethenyl]phenyl]ethenyl]benzene
CID 76573307
1-[(E)-3-iodoprop-1-enyl]-4-methoxybenzene
CID 135075727
1-ethyl-4-[(E)-2-(4-methoxyphenyl)ethenyl]benzene
CID 21449166
1-ethoxy-4-[3-(4-methylphenyl)prop-1-enyl]benzene
CID 58664971
1-methyl-4-[4-[3-[4-[4-(4-methylphenyl)phenyl]phenyl]prop-2-enyl]phenyl]benzene
CID 161223242
ethanamine;1-ethyl-4-[(E)-2-(4-methoxyphenyl)ethenyl]benzene
CID 159851450
[4-[(E)-3-(4-hydroxyphenyl)prop-2-enyl]phenyl] acetate
CID 166013014
4-(4-methoxyphenyl)but-2-enoic acid
CID 57252854

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-4-[(E)-3-(4-methoxyphenyl)prop-1-enyl]benzene?
The IUPAC name of 1-methoxy-4-[(E)-3-(4-methoxyphenyl)prop-1-enyl]benzene (CID 10800947) is 1-methoxy-4-[(E)-3-(4-methoxyphenyl)prop-1-enyl]benzene.
What is the SMILES notation for 1-methoxy-4-[(E)-3-(4-methoxyphenyl)prop-1-enyl]benzene?
The canonical SMILES for 1-methoxy-4-[(E)-3-(4-methoxyphenyl)prop-1-enyl]benzene is COc1ccc(/C=C/Cc2ccc(OC)cc2)cc1.
What is the InChIKey of 1-methoxy-4-[(E)-3-(4-methoxyphenyl)prop-1-enyl]benzene?
The InChIKey is PICCWFYLPLCYQJ-ONEGZZNKSA-N. The full InChI is InChI=1S/C17H18O2/c1-18-16-10-6-14(7-11-16)4-3-5-15-8-12-17(19-2)13-9-15/h3-4,6-13H,5H2,1-2H3/b4-3+.
What are the key properties of 1-methoxy-4-[(E)-3-(4-methoxyphenyl)prop-1-enyl]benzene?
1-methoxy-4-[(E)-3-(4-methoxyphenyl)prop-1-enyl]benzene has a molecular weight of 254.33 g/mol, XLogP of 3.96, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-4-[(E)-3-(4-methoxyphenyl)prop-1-enyl]benzene is sourced from PubChem (CID 10800947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).