1,5-dimethoxy-2-[3-[(3-methoxyphenyl)methoxy]phenyl]-4-propan-2-ylbenzene

C25H28O4 — CID 68971378

IUPAC1,5-dimethoxy-2-[3-[(3-methoxyphenyl)methoxy]phenyl]-4-propan-2-ylbenzene
SMILESCOc1cccc(COc2cccc(-c3cc(C(C)C)c(OC)cc3OC)c2)c1
InChIInChI=1S/C25H28O4/c1-17(2)22-14-23(25(28-5)15-24(22)27-4)19-9-7-11-21(13-19)29-16-18-8-6-10-20(12-18)26-3/h6-15,17H,16H2,1-5H3
InChIKeySDXCKQSHSDYYGQ-UHFFFAOYSA-N
MW392.50 g/mol
LogP6.08
Rot. Bonds8

About 1,5-dimethoxy-2-[3-[(3-methoxyphenyl)methoxy]phenyl]-4-propan-2-ylbenzene

1,5-dimethoxy-2-[3-[(3-methoxyphenyl)methoxy]phenyl]-4-propan-2-ylbenzene (PubChem CID 68971378) has the molecular formula C25H28O4 and a molecular weight of 392.50 g/mol. Its IUPAC name is 1,5-dimethoxy-2-[3-[(3-methoxyphenyl)methoxy]phenyl]-4-propan-2-ylbenzene.

Molecular Properties

Compound Name1,5-dimethoxy-2-[3-[(3-methoxyphenyl)methoxy]phenyl]-4-propan-2-ylbenzene
PubChem CID68971378
Molecular FormulaC25H28O4
Molecular Weight392.50 g/mol
Exact Mass392.20
IUPAC Name1,5-dimethoxy-2-[3-[(3-methoxyphenyl)methoxy]phenyl]-4-propan-2-ylbenzene
SMILESCOc1cccc(COc2cccc(-c3cc(C(C)C)c(OC)cc3OC)c2)c1
InChIInChI=1S/C25H28O4/c1-17(2)22-14-23(25(28-5)15-24(22)27-4)19-9-7-11-21(13-19)29-16-18-8-6-10-20(12-18)26-3/h6-15,17H,16H2,1-5H3
InChIKeySDXCKQSHSDYYGQ-UHFFFAOYSA-N
XLogP6.08
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500392.50
LogP ≤ 56.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-methoxy-3-[(2-propan-2-ylphenoxy)methyl]benzene
CID 60627362
1-chloro-3-[(3-methoxyphenyl)methoxy]benzene
CID 60627845
potassium trifluoro-[3-[(3-methoxyphenyl)methoxy]phenyl]boranuide
CID 63678299
(1R)-1-[2-fluoro-4-[(3-methoxyphenyl)methoxy]phenyl]ethanamine
CID 107718291
4-methoxy-3-(3-phenylmethoxyphenyl)benzaldehyde
CID 172879583
4-methoxy-2-(3-methoxyphenyl)-5-phenylmethoxyaniline
CID 66880803
4-[(3-methoxyphenyl)methoxy]benzene-1,2-diamine
CID 69307184
3-(3-phenylmethoxyphenyl)-2-propan-2-ylpyridine
CID 71204410
1-methoxy-3-[(2-methylphenoxy)methyl]benzene
CID 59416569
1-(bromomethyl)-4-methoxy-2-[(3-methoxyphenyl)methoxy]benzene
CID 61267436
6-[(3-methoxyphenyl)methoxy]-2-propan-2-ylpyrimidin-4-amine
CID 80965542
(1R)-1-[5-bromo-2-[(3-methoxyphenyl)methoxy]phenyl]ethanol
CID 63365872

Frequently Asked Questions

What is the IUPAC name of 1,5-dimethoxy-2-[3-[(3-methoxyphenyl)methoxy]phenyl]-4-propan-2-ylbenzene?
The IUPAC name of 1,5-dimethoxy-2-[3-[(3-methoxyphenyl)methoxy]phenyl]-4-propan-2-ylbenzene (CID 68971378) is 1,5-dimethoxy-2-[3-[(3-methoxyphenyl)methoxy]phenyl]-4-propan-2-ylbenzene.
What is the SMILES notation for 1,5-dimethoxy-2-[3-[(3-methoxyphenyl)methoxy]phenyl]-4-propan-2-ylbenzene?
The canonical SMILES for 1,5-dimethoxy-2-[3-[(3-methoxyphenyl)methoxy]phenyl]-4-propan-2-ylbenzene is COc1cccc(COc2cccc(-c3cc(C(C)C)c(OC)cc3OC)c2)c1.
What is the InChIKey of 1,5-dimethoxy-2-[3-[(3-methoxyphenyl)methoxy]phenyl]-4-propan-2-ylbenzene?
The InChIKey is SDXCKQSHSDYYGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H28O4/c1-17(2)22-14-23(25(28-5)15-24(22)27-4)19-9-7-11-21(13-19)29-16-18-8-6-10-20(12-18)26-3/h6-15,17H,16H2,1-5H3.
What are the key properties of 1,5-dimethoxy-2-[3-[(3-methoxyphenyl)methoxy]phenyl]-4-propan-2-ylbenzene?
1,5-dimethoxy-2-[3-[(3-methoxyphenyl)methoxy]phenyl]-4-propan-2-ylbenzene has a molecular weight of 392.50 g/mol, XLogP of 6.08, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dimethoxy-2-[3-[(3-methoxyphenyl)methoxy]phenyl]-4-propan-2-ylbenzene is sourced from PubChem (CID 68971378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).