methane;1-methoxy-4-(4-methoxy-3-methylphenyl)-2-methylbenzene

C17H22O2 — CID 161175155

IUPACmethane;1-methoxy-4-(4-methoxy-3-methylphenyl)-2-methylbenzene
SMILESC.COc1ccc(-c2ccc(OC)c(C)c2)cc1C
InChIInChI=1S/C16H18O2.CH4/c1-11-9-13(5-7-15(11)17-3)14-6-8-16(18-4)12(2)10-14;/h5-10H,1-4H3;1H4
InChIKeyURRXSZJLPIVFQZ-UHFFFAOYSA-N
MW258.36 g/mol
LogP4.62
Rot. Bonds3

About methane;1-methoxy-4-(4-methoxy-3-methylphenyl)-2-methylbenzene

methane;1-methoxy-4-(4-methoxy-3-methylphenyl)-2-methylbenzene (PubChem CID 161175155) has the molecular formula C17H22O2 and a molecular weight of 258.36 g/mol. Its IUPAC name is methane;1-methoxy-4-(4-methoxy-3-methylphenyl)-2-methylbenzene.

Molecular Properties

Compound Namemethane;1-methoxy-4-(4-methoxy-3-methylphenyl)-2-methylbenzene
PubChem CID161175155
Molecular FormulaC17H22O2
Molecular Weight258.36 g/mol
Exact Mass258.16
IUPAC Namemethane;1-methoxy-4-(4-methoxy-3-methylphenyl)-2-methylbenzene
SMILESC.COc1ccc(-c2ccc(OC)c(C)c2)cc1C
InChIInChI=1S/C16H18O2.CH4/c1-11-9-13(5-7-15(11)17-3)14-6-8-16(18-4)12(2)10-14;/h5-10H,1-4H3;1H4
InChIKeyURRXSZJLPIVFQZ-UHFFFAOYSA-N
XLogP4.62
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.36
LogP ≤ 54.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of methane;1-methoxy-4-(4-methoxy-3-methylphenyl)-2-methylbenzene?
The IUPAC name of methane;1-methoxy-4-(4-methoxy-3-methylphenyl)-2-methylbenzene (CID 161175155) is methane;1-methoxy-4-(4-methoxy-3-methylphenyl)-2-methylbenzene.
What is the SMILES notation for methane;1-methoxy-4-(4-methoxy-3-methylphenyl)-2-methylbenzene?
The canonical SMILES for methane;1-methoxy-4-(4-methoxy-3-methylphenyl)-2-methylbenzene is C.COc1ccc(-c2ccc(OC)c(C)c2)cc1C.
What is the InChIKey of methane;1-methoxy-4-(4-methoxy-3-methylphenyl)-2-methylbenzene?
The InChIKey is URRXSZJLPIVFQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18O2.CH4/c1-11-9-13(5-7-15(11)17-3)14-6-8-16(18-4)12(2)10-14;/h5-10H,1-4H3;1H4.
What are the key properties of methane;1-methoxy-4-(4-methoxy-3-methylphenyl)-2-methylbenzene?
methane;1-methoxy-4-(4-methoxy-3-methylphenyl)-2-methylbenzene has a molecular weight of 258.36 g/mol, XLogP of 4.62, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methane;1-methoxy-4-(4-methoxy-3-methylphenyl)-2-methylbenzene is sourced from PubChem (CID 161175155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).