methane;1-methoxy-4-[1-(4-methoxyphenyl)-2-methyl-1-phenylpropyl]benzene

C25H30O2 — CID 158331426

IUPACmethane;1-methoxy-4-[1-(4-methoxyphenyl)-2-methyl-1-phenylpropyl]benzene
SMILESC.COc1ccc(C(c2ccccc2)(c2ccc(OC)cc2)C(C)C)cc1
InChIInChI=1S/C24H26O2.CH4/c1-18(2)24(19-8-6-5-7-9-19,20-10-14-22(25-3)15-11-20)21-12-16-23(26-4)17-13-21;/h5-18H,1-4H3;1H4
InChIKeyGQBCRNAOODSFMW-UHFFFAOYSA-N
MW362.51 g/mol
LogP6.33
Rot. Bonds6

About methane;1-methoxy-4-[1-(4-methoxyphenyl)-2-methyl-1-phenylpropyl]benzene

methane;1-methoxy-4-[1-(4-methoxyphenyl)-2-methyl-1-phenylpropyl]benzene (PubChem CID 158331426) has the molecular formula C25H30O2 and a molecular weight of 362.51 g/mol. Its IUPAC name is methane;1-methoxy-4-[1-(4-methoxyphenyl)-2-methyl-1-phenylpropyl]benzene.

Molecular Properties

Compound Namemethane;1-methoxy-4-[1-(4-methoxyphenyl)-2-methyl-1-phenylpropyl]benzene
PubChem CID158331426
Molecular FormulaC25H30O2
Molecular Weight362.51 g/mol
Exact Mass362.22
IUPAC Namemethane;1-methoxy-4-[1-(4-methoxyphenyl)-2-methyl-1-phenylpropyl]benzene
SMILESC.COc1ccc(C(c2ccccc2)(c2ccc(OC)cc2)C(C)C)cc1
InChIInChI=1S/C24H26O2.CH4/c1-18(2)24(19-8-6-5-7-9-19,20-10-14-22(25-3)15-11-20)21-12-16-23(26-4)17-13-21;/h5-18H,1-4H3;1H4
InChIKeyGQBCRNAOODSFMW-UHFFFAOYSA-N
XLogP6.33
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms27
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500362.51
LogP ≤ 56.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of methane;1-methoxy-4-[1-(4-methoxyphenyl)-2-methyl-1-phenylpropyl]benzene?
The IUPAC name of methane;1-methoxy-4-[1-(4-methoxyphenyl)-2-methyl-1-phenylpropyl]benzene (CID 158331426) is methane;1-methoxy-4-[1-(4-methoxyphenyl)-2-methyl-1-phenylpropyl]benzene.
What is the SMILES notation for methane;1-methoxy-4-[1-(4-methoxyphenyl)-2-methyl-1-phenylpropyl]benzene?
The canonical SMILES for methane;1-methoxy-4-[1-(4-methoxyphenyl)-2-methyl-1-phenylpropyl]benzene is C.COc1ccc(C(c2ccccc2)(c2ccc(OC)cc2)C(C)C)cc1.
What is the InChIKey of methane;1-methoxy-4-[1-(4-methoxyphenyl)-2-methyl-1-phenylpropyl]benzene?
The InChIKey is GQBCRNAOODSFMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26O2.CH4/c1-18(2)24(19-8-6-5-7-9-19,20-10-14-22(25-3)15-11-20)21-12-16-23(26-4)17-13-21;/h5-18H,1-4H3;1H4.
What are the key properties of methane;1-methoxy-4-[1-(4-methoxyphenyl)-2-methyl-1-phenylpropyl]benzene?
methane;1-methoxy-4-[1-(4-methoxyphenyl)-2-methyl-1-phenylpropyl]benzene has a molecular weight of 362.51 g/mol, XLogP of 6.33, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methane;1-methoxy-4-[1-(4-methoxyphenyl)-2-methyl-1-phenylpropyl]benzene is sourced from PubChem (CID 158331426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).