2-[(2-ethylphenoxy)methyl]-1-methoxy-4-methylbenzene

C17H20O2 — CID 64766047

IUPAC2-[(2-ethylphenoxy)methyl]-1-methoxy-4-methylbenzene
SMILESCCc1ccccc1OCc1cc(C)ccc1OC
InChIInChI=1S/C17H20O2/c1-4-14-7-5-6-8-17(14)19-12-15-11-13(2)9-10-16(15)18-3/h5-11H,4,12H2,1-3H3
InChIKeyIYJXBWZAFHNOGB-UHFFFAOYSA-N
MW256.34 g/mol
LogP4.15
Rot. Bonds5

About 2-[(2-ethylphenoxy)methyl]-1-methoxy-4-methylbenzene

2-[(2-ethylphenoxy)methyl]-1-methoxy-4-methylbenzene (PubChem CID 64766047) has the molecular formula C17H20O2 and a molecular weight of 256.34 g/mol. Its IUPAC name is 2-[(2-ethylphenoxy)methyl]-1-methoxy-4-methylbenzene.

Molecular Properties

Compound Name2-[(2-ethylphenoxy)methyl]-1-methoxy-4-methylbenzene
PubChem CID64766047
Molecular FormulaC17H20O2
Molecular Weight256.34 g/mol
Exact Mass256.15
IUPAC Name2-[(2-ethylphenoxy)methyl]-1-methoxy-4-methylbenzene
SMILESCCc1ccccc1OCc1cc(C)ccc1OC
InChIInChI=1S/C17H20O2/c1-4-14-7-5-6-8-17(14)19-12-15-11-13(2)9-10-16(15)18-3/h5-11H,4,12H2,1-3H3
InChIKeyIYJXBWZAFHNOGB-UHFFFAOYSA-N
XLogP4.15
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.34
LogP ≤ 54.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-[[2-(chloromethyl)phenoxy]methyl]-1-methoxy-4-methylbenzene
CID 62161146
2-chloro-1-[(2-ethylphenoxy)methyl]-4-methylbenzene
CID 106870271
2-fluoro-1-[(2-methoxy-5-methylphenyl)methoxy]-3-methylbenzene
CID 107662038
2-[(3-ethylphenoxy)methyl]-1-methoxy-4-methylbenzene
CID 64765116
N-[1-[2-[(2-methoxy-5-methylphenyl)methoxy]phenyl]ethylidene]hydroxylamine
CID 76936776
1-[(2-ethylphenoxy)methyl]-2-fluoro-3-methoxybenzene
CID 104795197
2-[(2-methoxy-5-methylphenyl)methoxy]-5-methylbenzoic acid
CID 45447311
(1R)-1-[2-[(2-methoxyphenyl)methoxy]-5-methylphenyl]ethanol
CID 63366482
3-[2-[(2-methoxy-5-methylphenyl)methoxy]phenyl]prop-2-yn-1-amine
CID 62160017
1-[(5-bromo-2-methoxyphenyl)methoxy]-2-(bromomethyl)-4-methylbenzene
CID 63535753
3-[(2-methoxy-5-methylphenyl)methoxy]phenol
CID 62159960
CID 22216223
CID 22216223

Frequently Asked Questions

What is the IUPAC name of 2-[(2-ethylphenoxy)methyl]-1-methoxy-4-methylbenzene?
The IUPAC name of 2-[(2-ethylphenoxy)methyl]-1-methoxy-4-methylbenzene (CID 64766047) is 2-[(2-ethylphenoxy)methyl]-1-methoxy-4-methylbenzene.
What is the SMILES notation for 2-[(2-ethylphenoxy)methyl]-1-methoxy-4-methylbenzene?
The canonical SMILES for 2-[(2-ethylphenoxy)methyl]-1-methoxy-4-methylbenzene is CCc1ccccc1OCc1cc(C)ccc1OC.
What is the InChIKey of 2-[(2-ethylphenoxy)methyl]-1-methoxy-4-methylbenzene?
The InChIKey is IYJXBWZAFHNOGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20O2/c1-4-14-7-5-6-8-17(14)19-12-15-11-13(2)9-10-16(15)18-3/h5-11H,4,12H2,1-3H3.
What are the key properties of 2-[(2-ethylphenoxy)methyl]-1-methoxy-4-methylbenzene?
2-[(2-ethylphenoxy)methyl]-1-methoxy-4-methylbenzene has a molecular weight of 256.34 g/mol, XLogP of 4.15, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-ethylphenoxy)methyl]-1-methoxy-4-methylbenzene is sourced from PubChem (CID 64766047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).