1-methoxy-4-[(Z)-2-(4-methoxyphenyl)pent-2-en-3-yl]benzene

C19H22O2 — CID 13119213

IUPAC1-methoxy-4-[(Z)-2-(4-methoxyphenyl)pent-2-en-3-yl]benzene
SMILESCC/C(=C(\C)c1ccc(OC)cc1)c1ccc(OC)cc1
InChIInChI=1S/C19H22O2/c1-5-19(16-8-12-18(21-4)13-9-16)14(2)15-6-10-17(20-3)11-7-15/h6-13H,5H2,1-4H3/b19-14-
InChIKeyGLMZVDLRKUSZRC-RGEXLXHISA-N
MW282.38 g/mol
LogP5.04
Rot. Bonds5

About 1-methoxy-4-[(Z)-2-(4-methoxyphenyl)pent-2-en-3-yl]benzene

1-methoxy-4-[(Z)-2-(4-methoxyphenyl)pent-2-en-3-yl]benzene (PubChem CID 13119213) has the molecular formula C19H22O2 and a molecular weight of 282.38 g/mol. Its IUPAC name is 1-methoxy-4-[(Z)-2-(4-methoxyphenyl)pent-2-en-3-yl]benzene.

Molecular Properties

Compound Name1-methoxy-4-[(Z)-2-(4-methoxyphenyl)pent-2-en-3-yl]benzene
PubChem CID13119213
Molecular FormulaC19H22O2
Molecular Weight282.38 g/mol
Exact Mass282.16
IUPAC Name1-methoxy-4-[(Z)-2-(4-methoxyphenyl)pent-2-en-3-yl]benzene
SMILESCC/C(=C(\C)c1ccc(OC)cc1)c1ccc(OC)cc1
InChIInChI=1S/C19H22O2/c1-5-19(16-8-12-18(21-4)13-9-16)14(2)15-6-10-17(20-3)11-7-15/h6-13H,5H2,1-4H3/b19-14-
InChIKeyGLMZVDLRKUSZRC-RGEXLXHISA-N
XLogP5.04
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500282.38
LogP ≤ 55.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-methoxy-4-[(Z)-2-(4-methoxyphenyl)pent-2-en-3-yl]benzene?
The IUPAC name of 1-methoxy-4-[(Z)-2-(4-methoxyphenyl)pent-2-en-3-yl]benzene (CID 13119213) is 1-methoxy-4-[(Z)-2-(4-methoxyphenyl)pent-2-en-3-yl]benzene.
What is the SMILES notation for 1-methoxy-4-[(Z)-2-(4-methoxyphenyl)pent-2-en-3-yl]benzene?
The canonical SMILES for 1-methoxy-4-[(Z)-2-(4-methoxyphenyl)pent-2-en-3-yl]benzene is CC/C(=C(\C)c1ccc(OC)cc1)c1ccc(OC)cc1.
What is the InChIKey of 1-methoxy-4-[(Z)-2-(4-methoxyphenyl)pent-2-en-3-yl]benzene?
The InChIKey is GLMZVDLRKUSZRC-RGEXLXHISA-N. The full InChI is InChI=1S/C19H22O2/c1-5-19(16-8-12-18(21-4)13-9-16)14(2)15-6-10-17(20-3)11-7-15/h6-13H,5H2,1-4H3/b19-14-.
What are the key properties of 1-methoxy-4-[(Z)-2-(4-methoxyphenyl)pent-2-en-3-yl]benzene?
1-methoxy-4-[(Z)-2-(4-methoxyphenyl)pent-2-en-3-yl]benzene has a molecular weight of 282.38 g/mol, XLogP of 5.04, 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)-2-(4-methoxyphenyl)pent-2-en-3-yl]benzene is sourced from PubChem (CID 13119213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).