4-ethenyl-2-methoxy-1-[1-(2-phenoxyethoxy)ethoxy]benzene

C19H22O4 — CID 23114964

IUPAC4-ethenyl-2-methoxy-1-[1-(2-phenoxyethoxy)ethoxy]benzene
SMILESC=Cc1ccc(OC(C)OCCOc2ccccc2)c(OC)c1
InChIInChI=1S/C19H22O4/c1-4-16-10-11-18(19(14-16)20-3)23-15(2)21-12-13-22-17-8-6-5-7-9-17/h4-11,14-15H,1,12-13H2,2-3H3
InChIKeyOXDXGNUENUHSLG-UHFFFAOYSA-N
MW314.38 g/mol
LogP4.16
Rot. Bonds9

About 4-ethenyl-2-methoxy-1-[1-(2-phenoxyethoxy)ethoxy]benzene

4-ethenyl-2-methoxy-1-[1-(2-phenoxyethoxy)ethoxy]benzene (PubChem CID 23114964) has the molecular formula C19H22O4 and a molecular weight of 314.38 g/mol. Its IUPAC name is 4-ethenyl-2-methoxy-1-[1-(2-phenoxyethoxy)ethoxy]benzene.

Molecular Properties

Compound Name4-ethenyl-2-methoxy-1-[1-(2-phenoxyethoxy)ethoxy]benzene
PubChem CID23114964
Molecular FormulaC19H22O4
Molecular Weight314.38 g/mol
Exact Mass314.15
IUPAC Name4-ethenyl-2-methoxy-1-[1-(2-phenoxyethoxy)ethoxy]benzene
SMILESC=Cc1ccc(OC(C)OCCOc2ccccc2)c(OC)c1
InChIInChI=1S/C19H22O4/c1-4-16-10-11-18(19(14-16)20-3)23-15(2)21-12-13-22-17-8-6-5-7-9-17/h4-11,14-15H,1,12-13H2,2-3H3
InChIKeyOXDXGNUENUHSLG-UHFFFAOYSA-N
XLogP4.16
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.38
LogP ≤ 54.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Analyze 4-ethenyl-2-methoxy-1-[1-(2-phenoxyethoxy)ethoxy]benzene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-ethenoxy-4-[2-[1-(4-ethenylphenoxy)ethoxy]ethoxy]benzene
CID 139881216
4-ethenyl-1,2-dimethoxybenzene
CID 159733418
4-ethenyl-2-methoxy-1-(methoxymethoxy)benzene
CID 59623316
5-ethenyl-2-[2-[2-(4-ethenylphenoxy)ethoxy]ethoxy]-1,3-dimethoxybenzene
CID 11291660
(E)-3-[3-methoxy-4-(2-phenoxyethoxy)phenyl]-2-phenylprop-2-enoic acid
CID 22680499
5-ethenyl-1-iodo-3-methoxy-2-(1-phenoxyethoxy)benzene
CID 167145370
4-ethenyl-2-ethoxy-1-methoxybenzene
CID 11665489
4-ethenyl-2-ethoxy-1-propan-2-yloxybenzene
CID 118269443
(E)-3-[3-methoxy-4-(2-phenoxyethoxy)phenyl]-2-phenylprop-2-enenitrile
CID 7126688
3-methoxy-4-[2-(4-propan-2-ylphenoxy)ethoxy]benzaldehyde
CID 22684618
2-cyano-3-[3-methoxy-4-(2-phenoxyethoxy)phenyl]prop-2-enamide
CID 3518624
2-[chloro(methoxy)methyl]-4-ethenyl-1-methoxybenzene
CID 21064592

Frequently Asked Questions

What is the IUPAC name of 4-ethenyl-2-methoxy-1-[1-(2-phenoxyethoxy)ethoxy]benzene?
The IUPAC name of 4-ethenyl-2-methoxy-1-[1-(2-phenoxyethoxy)ethoxy]benzene (CID 23114964) is 4-ethenyl-2-methoxy-1-[1-(2-phenoxyethoxy)ethoxy]benzene.
What is the SMILES notation for 4-ethenyl-2-methoxy-1-[1-(2-phenoxyethoxy)ethoxy]benzene?
The canonical SMILES for 4-ethenyl-2-methoxy-1-[1-(2-phenoxyethoxy)ethoxy]benzene is C=Cc1ccc(OC(C)OCCOc2ccccc2)c(OC)c1.
What is the InChIKey of 4-ethenyl-2-methoxy-1-[1-(2-phenoxyethoxy)ethoxy]benzene?
The InChIKey is OXDXGNUENUHSLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22O4/c1-4-16-10-11-18(19(14-16)20-3)23-15(2)21-12-13-22-17-8-6-5-7-9-17/h4-11,14-15H,1,12-13H2,2-3H3.
What are the key properties of 4-ethenyl-2-methoxy-1-[1-(2-phenoxyethoxy)ethoxy]benzene?
4-ethenyl-2-methoxy-1-[1-(2-phenoxyethoxy)ethoxy]benzene has a molecular weight of 314.38 g/mol, XLogP of 4.16, 9 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethenyl-2-methoxy-1-[1-(2-phenoxyethoxy)ethoxy]benzene is sourced from PubChem (CID 23114964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).