1-methoxy-4-methyl-2,5-diphenylbenzene

C20H18O — CID 20717375

IUPAC1-methoxy-4-methyl-2,5-diphenylbenzene
SMILESCOc1cc(-c2ccccc2)c(C)cc1-c1ccccc1
InChIInChI=1S/C20H18O/c1-15-13-19(17-11-7-4-8-12-17)20(21-2)14-18(15)16-9-5-3-6-10-16/h3-14H,1-2H3
InChIKeyAIGUTDZPVFWVBY-UHFFFAOYSA-N
MW274.36 g/mol
LogP5.34
Rot. Bonds3

About 1-methoxy-4-methyl-2,5-diphenylbenzene

1-methoxy-4-methyl-2,5-diphenylbenzene (PubChem CID 20717375) has the molecular formula C20H18O and a molecular weight of 274.36 g/mol. Its IUPAC name is 1-methoxy-4-methyl-2,5-diphenylbenzene.

Molecular Properties

Compound Name1-methoxy-4-methyl-2,5-diphenylbenzene
PubChem CID20717375
Molecular FormulaC20H18O
Molecular Weight274.36 g/mol
Exact Mass274.14
IUPAC Name1-methoxy-4-methyl-2,5-diphenylbenzene
SMILESCOc1cc(-c2ccccc2)c(C)cc1-c1ccccc1
InChIInChI=1S/C20H18O/c1-15-13-19(17-11-7-4-8-12-17)20(21-2)14-18(15)16-9-5-3-6-10-16/h3-14H,1-2H3
InChIKeyAIGUTDZPVFWVBY-UHFFFAOYSA-N
XLogP5.34
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500274.36
LogP ≤ 55.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1,2,4-trimethoxy-5-phenylbenzene
CID 18788699
2-(2,5-dimethoxy-4-phenylphenyl)acetic acid
CID 4270797
1-(4-bromophenyl)-2-methoxy-4,5-dimethylbenzene
CID 83666215
2,7-dimethoxy-9-methyl-3,6-diphenylcarbazole
CID 143239757
1-(diaminomethylidene)-2-(2-methoxy-5-methyl-4-phenylphenyl)guanidine
CID 168601679
6,7-dimethoxy-1,4-diphenylnaphthalene
CID 134090814
4-bromo-2-methoxy-1-phenylbenzene
CID 18379655
7-methoxy-4-methyl-6-phenylchromen-2-one
CID 102307411
1,4-bis(2,6-dimethylphenyl)-2,5-dimethoxybenzene
CID 156631925
2-methoxy-1,4-dimethyl-3,5-diphenylbenzene
CID 173306181
4-benzyl-1-methoxy-2-phenylbenzene
CID 19420150
4-ethynyl-2-methoxy-1-phenylbenzene
CID 12788025

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-4-methyl-2,5-diphenylbenzene?
The IUPAC name of 1-methoxy-4-methyl-2,5-diphenylbenzene (CID 20717375) is 1-methoxy-4-methyl-2,5-diphenylbenzene.
What is the SMILES notation for 1-methoxy-4-methyl-2,5-diphenylbenzene?
The canonical SMILES for 1-methoxy-4-methyl-2,5-diphenylbenzene is COc1cc(-c2ccccc2)c(C)cc1-c1ccccc1.
What is the InChIKey of 1-methoxy-4-methyl-2,5-diphenylbenzene?
The InChIKey is AIGUTDZPVFWVBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18O/c1-15-13-19(17-11-7-4-8-12-17)20(21-2)14-18(15)16-9-5-3-6-10-16/h3-14H,1-2H3.
What are the key properties of 1-methoxy-4-methyl-2,5-diphenylbenzene?
1-methoxy-4-methyl-2,5-diphenylbenzene has a molecular weight of 274.36 g/mol, XLogP of 5.34, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-4-methyl-2,5-diphenylbenzene is sourced from PubChem (CID 20717375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).