1,4-dimethoxy-2,5-bis(2-phenylethyl)benzene

C24H26O2 — CID 102449129

IUPAC1,4-dimethoxy-2,5-bis(2-phenylethyl)benzene
SMILESCOc1cc(CCc2ccccc2)c(OC)cc1CCc1ccccc1
InChIInChI=1S/C24H26O2/c1-25-23-17-22(16-14-20-11-7-4-8-12-20)24(26-2)18-21(23)15-13-19-9-5-3-6-10-19/h3-12,17-18H,13-16H2,1-2H3
InChIKeyQIZFJAUXFGVONI-UHFFFAOYSA-N
MW346.47 g/mol
LogP5.27
Rot. Bonds8

About 1,4-dimethoxy-2,5-bis(2-phenylethyl)benzene

1,4-dimethoxy-2,5-bis(2-phenylethyl)benzene (PubChem CID 102449129) has the molecular formula C24H26O2 and a molecular weight of 346.47 g/mol. Its IUPAC name is 1,4-dimethoxy-2,5-bis(2-phenylethyl)benzene.

Molecular Properties

Compound Name1,4-dimethoxy-2,5-bis(2-phenylethyl)benzene
PubChem CID102449129
Molecular FormulaC24H26O2
Molecular Weight346.47 g/mol
Exact Mass346.19
IUPAC Name1,4-dimethoxy-2,5-bis(2-phenylethyl)benzene
SMILESCOc1cc(CCc2ccccc2)c(OC)cc1CCc1ccccc1
InChIInChI=1S/C24H26O2/c1-25-23-17-22(16-14-20-11-7-4-8-12-20)24(26-2)18-21(23)15-13-19-9-5-3-6-10-19/h3-12,17-18H,13-16H2,1-2H3
InChIKeyQIZFJAUXFGVONI-UHFFFAOYSA-N
XLogP5.27
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500346.47
LogP ≤ 55.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1,2,3,4-tetramethoxy-5-(2-phenylethyl)benzene
CID 174438503
4,5-dimethoxy-2-(2-phenylethyl)phenol
CID 174923457
2-fluoro-4-methoxy-5-(2-phenylethyl)aniline
CID 58021975
1,5-dibenzyl-2,4-dimethoxybenzene
CID 134865682
2-benzyl-1-methoxy-3-(2-phenylethyl)benzene
CID 173327548
2-methoxy-1-nitro-4-(2-phenylethyl)naphthalene
CID 13239131
1,5-dimethoxy-2-[2-(4-methoxyphenyl)ethyl]-4-[4-[2-(3-methoxyphenyl)ethyl]phenoxy]benzene
CID 172871445
1,2-dimethoxy-4-[[2-(2-phenylethyl)phenoxy]methyl]benzene
CID 24807987
1-[2-methoxy-6-(2-phenylethyl)phenyl]ethanone
CID 102035798
1-[2,4-dimethoxy-5-[2-(3-methoxyphenyl)ethyl]phenyl]-2,4-dimethoxy-5-[2-(3-methoxyphenyl)ethyl]benzene
CID 172870468
1-benzyl-4-bromo-2,5-dimethoxybenzene
CID 90014270
1-(3-phenylpropyl)-3-[2-(2,4,5-trimethoxyphenyl)ethyl]urea
CID 113217263

Frequently Asked Questions

What is the IUPAC name of 1,4-dimethoxy-2,5-bis(2-phenylethyl)benzene?
The IUPAC name of 1,4-dimethoxy-2,5-bis(2-phenylethyl)benzene (CID 102449129) is 1,4-dimethoxy-2,5-bis(2-phenylethyl)benzene.
What is the SMILES notation for 1,4-dimethoxy-2,5-bis(2-phenylethyl)benzene?
The canonical SMILES for 1,4-dimethoxy-2,5-bis(2-phenylethyl)benzene is COc1cc(CCc2ccccc2)c(OC)cc1CCc1ccccc1.
What is the InChIKey of 1,4-dimethoxy-2,5-bis(2-phenylethyl)benzene?
The InChIKey is QIZFJAUXFGVONI-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26O2/c1-25-23-17-22(16-14-20-11-7-4-8-12-20)24(26-2)18-21(23)15-13-19-9-5-3-6-10-19/h3-12,17-18H,13-16H2,1-2H3.
What are the key properties of 1,4-dimethoxy-2,5-bis(2-phenylethyl)benzene?
1,4-dimethoxy-2,5-bis(2-phenylethyl)benzene has a molecular weight of 346.47 g/mol, XLogP of 5.27, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-dimethoxy-2,5-bis(2-phenylethyl)benzene is sourced from PubChem (CID 102449129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).