1-methoxy-4-[(4-methoxyphenyl)-[(2-methylpropan-2-yl)oxy]methyl]benzene

C19H24O3 — CID 102295760

IUPAC1-methoxy-4-[(4-methoxyphenyl)-[(2-methylpropan-2-yl)oxy]methyl]benzene
SMILESCOc1ccc(C(OC(C)(C)C)c2ccc(OC)cc2)cc1
InChIInChI=1S/C19H24O3/c1-19(2,3)22-18(14-6-10-16(20-4)11-7-14)15-8-12-17(21-5)13-9-15/h6-13,18H,1-5H3
InChIKeyHMGKIHSNBLDQKZ-UHFFFAOYSA-N
MW300.40 g/mol
LogP4.61
Rot. Bonds5

About 1-methoxy-4-[(4-methoxyphenyl)-[(2-methylpropan-2-yl)oxy]methyl]benzene

1-methoxy-4-[(4-methoxyphenyl)-[(2-methylpropan-2-yl)oxy]methyl]benzene (PubChem CID 102295760) has the molecular formula C19H24O3 and a molecular weight of 300.40 g/mol. Its IUPAC name is 1-methoxy-4-[(4-methoxyphenyl)-[(2-methylpropan-2-yl)oxy]methyl]benzene.

Molecular Properties

Compound Name1-methoxy-4-[(4-methoxyphenyl)-[(2-methylpropan-2-yl)oxy]methyl]benzene
PubChem CID102295760
Molecular FormulaC19H24O3
Molecular Weight300.40 g/mol
Exact Mass300.17
IUPAC Name1-methoxy-4-[(4-methoxyphenyl)-[(2-methylpropan-2-yl)oxy]methyl]benzene
SMILESCOc1ccc(C(OC(C)(C)C)c2ccc(OC)cc2)cc1
InChIInChI=1S/C19H24O3/c1-19(2,3)22-18(14-6-10-16(20-4)11-7-14)15-8-12-17(21-5)13-9-15/h6-13,18H,1-5H3
InChIKeyHMGKIHSNBLDQKZ-UHFFFAOYSA-N
XLogP4.61
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.40
LogP ≤ 54.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-methoxyphenyl)-N-methyl-2-[(2-methylpropan-2-yl)oxy]ethanamine
CID 62108025
N-[(1R)-1-(4-methoxyphenyl)ethyl]-2-methylpropan-2-amine
CID 58628220
1-methoxy-4-[(E)-3-[(2-methylpropan-2-yl)oxy]but-1-enyl]benzene
CID 14939551
(4-methoxyphenyl)methanedithiol
CID 19893185
1-[fluoro-(4-methoxyphenyl)methyl]-4-methoxybenzene
CID 15206991
1-methoxy-4-(2,2,5,5-tetramethylhexan-3-yl)benzene
CID 67966968
2-methoxy-1-(4-methoxyphenyl)-2-methylpropan-1-ol
CID 12658876
tert-butyl (2R)-2-amino-2-(4-methoxyphenyl)acetate
CID 92840712
tert-butyl (2S)-2-amino-2-(4-methoxyphenyl)acetate
CID 92840713
1-methoxy-4-[[(4-methoxyphenyl)-(4-methylsulfanylphenyl)methoxy]-(4-methylsulfanylphenyl)methyl]benzene
CID 71570344
1-(1-chloro-3,3-dimethylbutyl)-4-methoxybenzene
CID 63429185
1-(3,3-dimethylpentan-2-yl)-4-methoxybenzene
CID 173309676

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-4-[(4-methoxyphenyl)-[(2-methylpropan-2-yl)oxy]methyl]benzene?
The IUPAC name of 1-methoxy-4-[(4-methoxyphenyl)-[(2-methylpropan-2-yl)oxy]methyl]benzene (CID 102295760) is 1-methoxy-4-[(4-methoxyphenyl)-[(2-methylpropan-2-yl)oxy]methyl]benzene.
What is the SMILES notation for 1-methoxy-4-[(4-methoxyphenyl)-[(2-methylpropan-2-yl)oxy]methyl]benzene?
The canonical SMILES for 1-methoxy-4-[(4-methoxyphenyl)-[(2-methylpropan-2-yl)oxy]methyl]benzene is COc1ccc(C(OC(C)(C)C)c2ccc(OC)cc2)cc1.
What is the InChIKey of 1-methoxy-4-[(4-methoxyphenyl)-[(2-methylpropan-2-yl)oxy]methyl]benzene?
The InChIKey is HMGKIHSNBLDQKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24O3/c1-19(2,3)22-18(14-6-10-16(20-4)11-7-14)15-8-12-17(21-5)13-9-15/h6-13,18H,1-5H3.
What are the key properties of 1-methoxy-4-[(4-methoxyphenyl)-[(2-methylpropan-2-yl)oxy]methyl]benzene?
1-methoxy-4-[(4-methoxyphenyl)-[(2-methylpropan-2-yl)oxy]methyl]benzene has a molecular weight of 300.40 g/mol, XLogP of 4.61, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-4-[(4-methoxyphenyl)-[(2-methylpropan-2-yl)oxy]methyl]benzene is sourced from PubChem (CID 102295760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).