1-methoxy-4-[(Z)-1-(4-methoxyphenyl)but-1-en-2-yl]benzene

C18H20O2 — CID 22860829

IUPAC1-methoxy-4-[(Z)-1-(4-methoxyphenyl)but-1-en-2-yl]benzene
SMILESCC/C(=C/c1ccc(OC)cc1)c1ccc(OC)cc1
InChIInChI=1S/C18H20O2/c1-4-15(16-7-11-18(20-3)12-8-16)13-14-5-9-17(19-2)10-6-14/h5-13H,4H2,1-3H3/b15-13-
InChIKeyGDNNLCVGDNIIBD-SQFISAMPSA-N
MW268.36 g/mol
LogP4.65
Rot. Bonds5

About 1-methoxy-4-[(Z)-1-(4-methoxyphenyl)but-1-en-2-yl]benzene

1-methoxy-4-[(Z)-1-(4-methoxyphenyl)but-1-en-2-yl]benzene (PubChem CID 22860829) has the molecular formula C18H20O2 and a molecular weight of 268.36 g/mol. Its IUPAC name is 1-methoxy-4-[(Z)-1-(4-methoxyphenyl)but-1-en-2-yl]benzene.

Molecular Properties

Compound Name1-methoxy-4-[(Z)-1-(4-methoxyphenyl)but-1-en-2-yl]benzene
PubChem CID22860829
Molecular FormulaC18H20O2
Molecular Weight268.36 g/mol
Exact Mass268.15
IUPAC Name1-methoxy-4-[(Z)-1-(4-methoxyphenyl)but-1-en-2-yl]benzene
SMILESCC/C(=C/c1ccc(OC)cc1)c1ccc(OC)cc1
InChIInChI=1S/C18H20O2/c1-4-15(16-7-11-18(20-3)12-8-16)13-14-5-9-17(19-2)10-6-14/h5-13H,4H2,1-3H3/b15-13-
InChIKeyGDNNLCVGDNIIBD-SQFISAMPSA-N
XLogP4.65
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 54.65
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

1-methoxy-4-pent-2-en-3-ylbenzene
CID 85440848
ethyl 3,4-bis(4-methoxyphenyl)but-3-enoate
CID 67000278
1-(2,2-dibromoethenyl)-4-methoxybenzene
CID 10859278
2-[(4-methoxyphenyl)methylidene]butan-1-amine
CID 79321876
2-[(Z)-1-phenylbut-1-en-2-yl]naphthalene
CID 58787072
1-methoxy-4-[(Z)-1-nitrobut-1-en-2-yl]benzene
CID 146168276
1-methoxy-4-oct-4-en-4-ylbenzene
CID 72965234
1-[2,2-bis(4-methoxyphenyl)ethenyl]-4-bromobenzene
CID 66556000
1-[(E)-2-fluoroprop-1-enyl]-4-methoxybenzene
CID 125475931
methyl (E)-3-[4-(4-methoxyphenyl)phenyl]pent-2-enoate
CID 82543564
(E)-3-(4-methoxyphenyl)-1-phenylpent-2-en-1-one
CID 135075979
5-(4-methoxyphenyl)hepta-2,4-dienoic acid
CID 54040855

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-4-[(Z)-1-(4-methoxyphenyl)but-1-en-2-yl]benzene?
The IUPAC name of 1-methoxy-4-[(Z)-1-(4-methoxyphenyl)but-1-en-2-yl]benzene (CID 22860829) is 1-methoxy-4-[(Z)-1-(4-methoxyphenyl)but-1-en-2-yl]benzene.
What is the SMILES notation for 1-methoxy-4-[(Z)-1-(4-methoxyphenyl)but-1-en-2-yl]benzene?
The canonical SMILES for 1-methoxy-4-[(Z)-1-(4-methoxyphenyl)but-1-en-2-yl]benzene is CC/C(=C/c1ccc(OC)cc1)c1ccc(OC)cc1.
What is the InChIKey of 1-methoxy-4-[(Z)-1-(4-methoxyphenyl)but-1-en-2-yl]benzene?
The InChIKey is GDNNLCVGDNIIBD-SQFISAMPSA-N. The full InChI is InChI=1S/C18H20O2/c1-4-15(16-7-11-18(20-3)12-8-16)13-14-5-9-17(19-2)10-6-14/h5-13H,4H2,1-3H3/b15-13-.
What are the key properties of 1-methoxy-4-[(Z)-1-(4-methoxyphenyl)but-1-en-2-yl]benzene?
1-methoxy-4-[(Z)-1-(4-methoxyphenyl)but-1-en-2-yl]benzene has a molecular weight of 268.36 g/mol, XLogP of 4.65, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-4-[(Z)-1-(4-methoxyphenyl)but-1-en-2-yl]benzene is sourced from PubChem (CID 22860829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).