2-methoxy-4-(2-methoxyethyl)-1-phenylmethoxybenzene

C17H20O3 — CID 135032978

IUPAC2-methoxy-4-(2-methoxyethyl)-1-phenylmethoxybenzene
SMILESCOCCc1ccc(OCc2ccccc2)c(OC)c1
InChIInChI=1S/C17H20O3/c1-18-11-10-14-8-9-16(17(12-14)19-2)20-13-15-6-4-3-5-7-15/h3-9,12H,10-11,13H2,1-2H3
InChIKeyXATYPUDPWLDQGX-UHFFFAOYSA-N
MW272.34 g/mol
LogP3.46
Rot. Bonds7

About 2-methoxy-4-(2-methoxyethyl)-1-phenylmethoxybenzene

2-methoxy-4-(2-methoxyethyl)-1-phenylmethoxybenzene (PubChem CID 135032978) has the molecular formula C17H20O3 and a molecular weight of 272.34 g/mol. Its IUPAC name is 2-methoxy-4-(2-methoxyethyl)-1-phenylmethoxybenzene.

Molecular Properties

Compound Name2-methoxy-4-(2-methoxyethyl)-1-phenylmethoxybenzene
PubChem CID135032978
Molecular FormulaC17H20O3
Molecular Weight272.34 g/mol
Exact Mass272.14
IUPAC Name2-methoxy-4-(2-methoxyethyl)-1-phenylmethoxybenzene
SMILESCOCCc1ccc(OCc2ccccc2)c(OC)c1
InChIInChI=1S/C17H20O3/c1-18-11-10-14-8-9-16(17(12-14)19-2)20-13-15-6-4-3-5-7-15/h3-9,12H,10-11,13H2,1-2H3
InChIKeyXATYPUDPWLDQGX-UHFFFAOYSA-N
XLogP3.46
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.34
LogP ≤ 53.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-methoxy-4-phenylmethoxyphenyl)ethylazanium chloride
CID 2752224
4-(iodomethyl)-2-methoxy-1-phenylmethoxybenzene
CID 11164050
3-(3-methoxy-4-phenylmethoxyphenyl)propanoic acid
CID 2752415
3-(3-methoxy-4-phenylmethoxyphenyl)propanamide
CID 18442581
4-(3-methoxy-4-phenylmethoxyphenyl)butanoic acid
CID 117484134
methyl 2-[4-(2-methoxyethyl)-2-phenylmethoxyphenyl]acetate
CID 141452623
2-(4-methoxy-3-phenylmethoxyphenyl)-N,N-dimethylethanamine
CID 18986890
1,1,2,2-tetradeuterio-2-(3-methoxy-4-phenylmethoxyphenyl)ethanamine
CID 131667709
3-methoxy-4-phenylmethoxyaniline
CID 27226
N-benzyl-N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]-2-phenylethanamine
CID 2845777
[3-methoxy-4-(2-phenylethoxy)phenyl]methanol
CID 28562144
4-(2,2-dimethoxy-2-tritioethyl)-2-methoxy-1-phenylmethoxybenzene
CID 10780824

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-4-(2-methoxyethyl)-1-phenylmethoxybenzene?
The IUPAC name of 2-methoxy-4-(2-methoxyethyl)-1-phenylmethoxybenzene (CID 135032978) is 2-methoxy-4-(2-methoxyethyl)-1-phenylmethoxybenzene.
What is the SMILES notation for 2-methoxy-4-(2-methoxyethyl)-1-phenylmethoxybenzene?
The canonical SMILES for 2-methoxy-4-(2-methoxyethyl)-1-phenylmethoxybenzene is COCCc1ccc(OCc2ccccc2)c(OC)c1.
What is the InChIKey of 2-methoxy-4-(2-methoxyethyl)-1-phenylmethoxybenzene?
The InChIKey is XATYPUDPWLDQGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20O3/c1-18-11-10-14-8-9-16(17(12-14)19-2)20-13-15-6-4-3-5-7-15/h3-9,12H,10-11,13H2,1-2H3.
What are the key properties of 2-methoxy-4-(2-methoxyethyl)-1-phenylmethoxybenzene?
2-methoxy-4-(2-methoxyethyl)-1-phenylmethoxybenzene has a molecular weight of 272.34 g/mol, XLogP of 3.46, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-4-(2-methoxyethyl)-1-phenylmethoxybenzene is sourced from PubChem (CID 135032978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).