1-methoxy-2-[(1R)-2-methoxy-1-phenylethoxy]benzene

C16H18O3 — CID 139888612

IUPAC1-methoxy-2-[(1R)-2-methoxy-1-phenylethoxy]benzene
SMILESCOC[C@H](Oc1ccccc1OC)c1ccccc1
InChIInChI=1S/C16H18O3/c1-17-12-16(13-8-4-3-5-9-13)19-15-11-7-6-10-14(15)18-2/h3-11,16H,12H2,1-2H3/t16-/m0/s1
InChIKeyQSXZTESCNWIZBI-INIZCTEOSA-N
MW258.32 g/mol
LogP3.46
Rot. Bonds6

About 1-methoxy-2-[(1R)-2-methoxy-1-phenylethoxy]benzene

1-methoxy-2-[(1R)-2-methoxy-1-phenylethoxy]benzene (PubChem CID 139888612) has the molecular formula C16H18O3 and a molecular weight of 258.32 g/mol. Its IUPAC name is 1-methoxy-2-[(1R)-2-methoxy-1-phenylethoxy]benzene.

Molecular Properties

Compound Name1-methoxy-2-[(1R)-2-methoxy-1-phenylethoxy]benzene
PubChem CID139888612
Molecular FormulaC16H18O3
Molecular Weight258.32 g/mol
Exact Mass258.13
IUPAC Name1-methoxy-2-[(1R)-2-methoxy-1-phenylethoxy]benzene
SMILESCOC[C@H](Oc1ccccc1OC)c1ccccc1
InChIInChI=1S/C16H18O3/c1-17-12-16(13-8-4-3-5-9-13)19-15-11-7-6-10-14(15)18-2/h3-11,16H,12H2,1-2H3/t16-/m0/s1
InChIKeyQSXZTESCNWIZBI-INIZCTEOSA-N
XLogP3.46
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 53.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

benzene;[(1R)-1,2-dimethoxyethyl]benzene
CID 178156280
1-methoxy-2-[(2R)-2-methoxy-2-phenylethoxy]benzene
CID 139888688
hydron;3-(2-methoxyphenoxy)-N-methyl-3-phenylpropan-1-amine;chloride
CID 74765078
O-(2-methoxy-1-phenylethyl)hydroxylamine
CID 14103730
3-methoxy-2-(2-methoxyphenoxy)propanoic acid
CID 103223945
3-(2-methoxyphenoxy)-N-methyl-3-phenylpropan-1-amine;3-[(2-methoxyphenyl)methoxy]-N-methyl-3-phenylpropan-1-amine
CID 161266462
2-[[(3R)-3-(2-methoxyphenoxy)-3-phenylpropyl]-methylamino]acetic acid
CID 101120687
methyl (4R)-4-(2-methoxyphenoxy)-2-nitro-4-phenylbutanoate
CID 102389342
2-(2-methoxy-4-methylphenoxy)-2-phenylethanamine
CID 55017730
[(1R)-2-methoxy-1-phenylethyl] acetate
CID 101055201
1-benzyl-4-[3-(2-methoxyphenoxy)-3-phenylpropyl]piperazine;hydron;dichloride
CID 50987098
tert-butyl N-[(3R)-3-(2-methoxyphenoxy)-3-phenylpropyl]-N-methylcarbamate
CID 142700885

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-2-[(1R)-2-methoxy-1-phenylethoxy]benzene?
The IUPAC name of 1-methoxy-2-[(1R)-2-methoxy-1-phenylethoxy]benzene (CID 139888612) is 1-methoxy-2-[(1R)-2-methoxy-1-phenylethoxy]benzene.
What is the SMILES notation for 1-methoxy-2-[(1R)-2-methoxy-1-phenylethoxy]benzene?
The canonical SMILES for 1-methoxy-2-[(1R)-2-methoxy-1-phenylethoxy]benzene is COC[C@H](Oc1ccccc1OC)c1ccccc1.
What is the InChIKey of 1-methoxy-2-[(1R)-2-methoxy-1-phenylethoxy]benzene?
The InChIKey is QSXZTESCNWIZBI-INIZCTEOSA-N. The full InChI is InChI=1S/C16H18O3/c1-17-12-16(13-8-4-3-5-9-13)19-15-11-7-6-10-14(15)18-2/h3-11,16H,12H2,1-2H3/t16-/m0/s1.
What are the key properties of 1-methoxy-2-[(1R)-2-methoxy-1-phenylethoxy]benzene?
1-methoxy-2-[(1R)-2-methoxy-1-phenylethoxy]benzene has a molecular weight of 258.32 g/mol, XLogP of 3.46, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-2-[(1R)-2-methoxy-1-phenylethoxy]benzene is sourced from PubChem (CID 139888612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).