1-methoxy-4-[1-methoxy-1-(4-methoxyphenyl)ethyl]benzene

C17H20O3 — CID 100982680

IUPAC1-methoxy-4-[1-methoxy-1-(4-methoxyphenyl)ethyl]benzene
SMILESCOc1ccc(C(C)(OC)c2ccc(OC)cc2)cc1
InChIInChI=1S/C17H20O3/c1-17(20-4,13-5-9-15(18-2)10-6-13)14-7-11-16(19-3)12-8-14/h5-12H,1-4H3
InChIKeyJMPVHDBTAKAYPC-UHFFFAOYSA-N
MW272.34 g/mol
LogP3.61
Rot. Bonds5

About 1-methoxy-4-[1-methoxy-1-(4-methoxyphenyl)ethyl]benzene

1-methoxy-4-[1-methoxy-1-(4-methoxyphenyl)ethyl]benzene (PubChem CID 100982680) has the molecular formula C17H20O3 and a molecular weight of 272.34 g/mol. Its IUPAC name is 1-methoxy-4-[1-methoxy-1-(4-methoxyphenyl)ethyl]benzene.

Molecular Properties

Compound Name1-methoxy-4-[1-methoxy-1-(4-methoxyphenyl)ethyl]benzene
PubChem CID100982680
Molecular FormulaC17H20O3
Molecular Weight272.34 g/mol
Exact Mass272.14
IUPAC Name1-methoxy-4-[1-methoxy-1-(4-methoxyphenyl)ethyl]benzene
SMILESCOc1ccc(C(C)(OC)c2ccc(OC)cc2)cc1
InChIInChI=1S/C17H20O3/c1-17(20-4,13-5-9-15(18-2)10-6-13)14-7-11-16(19-3)12-8-14/h5-12H,1-4H3
InChIKeyJMPVHDBTAKAYPC-UHFFFAOYSA-N
XLogP3.61
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.34
LogP ≤ 53.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1,4-bis[dimethoxy-(4-methoxyphenyl)methyl]benzene
CID 86224004
CID 102373172
CID 102373172
bis[2-(4-methoxyphenyl)propan-2-yl]diazene
CID 101224810
[4-[(1S)-1-chloro-1-(4-methoxyphenyl)ethyl]phenoxy]phosphane
CID 71129441
2-methoxy-2-(4-methoxyphenyl)propan-1-ol
CID 105449931
[2-[bis(4-methoxyphenyl)-phosphanylmethyl]-1,1,3,3-tetrakis(4-methoxyphenyl)-2-methyl-3-phosphanylpropyl]phosphane
CID 87392310
1-methoxy-4-(2-methylsulfanylpropan-2-yl)benzene
CID 123567151
(1R)-1-iodo-1-(4-methoxyphenyl)ethanamine
CID 68562835
1-methoxy-4-[2,2,2-trichloro-1-methoxy-1-(4-methoxyphenyl)ethyl]benzene
CID 91491822
4-[1-(4-hydroxyphenyl)-1-(4-methoxyphenyl)ethyl]phenol
CID 19875161
2-(4-methoxyphenyl)butan-2-ol
CID 10307904
1-tert-butyl-4-[(4-methoxyphenyl)-phenylmethyl]benzene
CID 102293623

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-4-[1-methoxy-1-(4-methoxyphenyl)ethyl]benzene?
The IUPAC name of 1-methoxy-4-[1-methoxy-1-(4-methoxyphenyl)ethyl]benzene (CID 100982680) is 1-methoxy-4-[1-methoxy-1-(4-methoxyphenyl)ethyl]benzene.
What is the SMILES notation for 1-methoxy-4-[1-methoxy-1-(4-methoxyphenyl)ethyl]benzene?
The canonical SMILES for 1-methoxy-4-[1-methoxy-1-(4-methoxyphenyl)ethyl]benzene is COc1ccc(C(C)(OC)c2ccc(OC)cc2)cc1.
What is the InChIKey of 1-methoxy-4-[1-methoxy-1-(4-methoxyphenyl)ethyl]benzene?
The InChIKey is JMPVHDBTAKAYPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20O3/c1-17(20-4,13-5-9-15(18-2)10-6-13)14-7-11-16(19-3)12-8-14/h5-12H,1-4H3.
What are the key properties of 1-methoxy-4-[1-methoxy-1-(4-methoxyphenyl)ethyl]benzene?
1-methoxy-4-[1-methoxy-1-(4-methoxyphenyl)ethyl]benzene has a molecular weight of 272.34 g/mol, XLogP of 3.61, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-4-[1-methoxy-1-(4-methoxyphenyl)ethyl]benzene is sourced from PubChem (CID 100982680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).