2-methoxy-5-methyl-4-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenol

C19H22O5 — CID 142237968

IUPAC2-methoxy-5-methyl-4-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenol
SMILESCOc1cc(/C=C\c2cc(OC)c(OC)c(OC)c2)c(C)cc1O
InChIInChI=1S/C19H22O5/c1-12-8-15(20)16(21-2)11-14(12)7-6-13-9-17(22-3)19(24-5)18(10-13)23-4/h6-11,20H,1-5H3/b7-6-
InChIKeyMXIVDSIOFHMZGG-SREVYHEPSA-N
MW330.38 g/mol
LogP3.91
Rot. Bonds6

About 2-methoxy-5-methyl-4-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenol

2-methoxy-5-methyl-4-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenol (PubChem CID 142237968) has the molecular formula C19H22O5 and a molecular weight of 330.38 g/mol. Its IUPAC name is 2-methoxy-5-methyl-4-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenol.

Molecular Properties

Compound Name2-methoxy-5-methyl-4-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenol
PubChem CID142237968
Molecular FormulaC19H22O5
Molecular Weight330.38 g/mol
Exact Mass330.15
IUPAC Name2-methoxy-5-methyl-4-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenol
SMILESCOc1cc(/C=C\c2cc(OC)c(OC)c(OC)c2)c(C)cc1O
InChIInChI=1S/C19H22O5/c1-12-8-15(20)16(21-2)11-14(12)7-6-13-9-17(22-3)19(24-5)18(10-13)23-4/h6-11,20H,1-5H3/b7-6-
InChIKeyMXIVDSIOFHMZGG-SREVYHEPSA-N
XLogP3.91
TPSA57.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.38
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-5-methyl-4-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenol?
The IUPAC name of 2-methoxy-5-methyl-4-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenol (CID 142237968) is 2-methoxy-5-methyl-4-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenol.
What is the SMILES notation for 2-methoxy-5-methyl-4-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenol?
The canonical SMILES for 2-methoxy-5-methyl-4-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenol is COc1cc(/C=C\c2cc(OC)c(OC)c(OC)c2)c(C)cc1O.
What is the InChIKey of 2-methoxy-5-methyl-4-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenol?
The InChIKey is MXIVDSIOFHMZGG-SREVYHEPSA-N. The full InChI is InChI=1S/C19H22O5/c1-12-8-15(20)16(21-2)11-14(12)7-6-13-9-17(22-3)19(24-5)18(10-13)23-4/h6-11,20H,1-5H3/b7-6-.
What are the key properties of 2-methoxy-5-methyl-4-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenol?
2-methoxy-5-methyl-4-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenol has a molecular weight of 330.38 g/mol, XLogP of 3.91, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-5-methyl-4-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenol is sourced from PubChem (CID 142237968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).