2-[2-[(2,5-dimethylphenyl)methoxy]-5-methoxyphenyl]ethanamine

C18H23NO2 — CID 61482092

IUPAC2-[2-[(2,5-dimethylphenyl)methoxy]-5-methoxyphenyl]ethanamine
SMILESCOc1ccc(OCc2cc(C)ccc2C)c(CCN)c1
InChIInChI=1S/C18H23NO2/c1-13-4-5-14(2)16(10-13)12-21-18-7-6-17(20-3)11-15(18)8-9-19/h4-7,10-11H,8-9,12,19H2,1-3H3
InChIKeyLTBDYEWCNIODJF-UHFFFAOYSA-N
MW285.39 g/mol
LogP3.39
Rot. Bonds6

About 2-[2-[(2,5-dimethylphenyl)methoxy]-5-methoxyphenyl]ethanamine

2-[2-[(2,5-dimethylphenyl)methoxy]-5-methoxyphenyl]ethanamine (PubChem CID 61482092) has the molecular formula C18H23NO2 and a molecular weight of 285.39 g/mol. Its IUPAC name is 2-[2-[(2,5-dimethylphenyl)methoxy]-5-methoxyphenyl]ethanamine.

Molecular Properties

Compound Name2-[2-[(2,5-dimethylphenyl)methoxy]-5-methoxyphenyl]ethanamine
PubChem CID61482092
Molecular FormulaC18H23NO2
Molecular Weight285.39 g/mol
Exact Mass285.17
IUPAC Name2-[2-[(2,5-dimethylphenyl)methoxy]-5-methoxyphenyl]ethanamine
SMILESCOc1ccc(OCc2cc(C)ccc2C)c(CCN)c1
InChIInChI=1S/C18H23NO2/c1-13-4-5-14(2)16(10-13)12-21-18-7-6-17(20-3)11-15(18)8-9-19/h4-7,10-11H,8-9,12,19H2,1-3H3
InChIKeyLTBDYEWCNIODJF-UHFFFAOYSA-N
XLogP3.39
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[2-[(2,5-dimethylphenyl)methoxy]-5-methoxyphenyl]methanamine
CID 61481790
2-[5-methoxy-2-[(4-methylphenyl)methoxy]phenyl]ethanamine
CID 60906080
2-bromo-1-[(2,5-dimethylphenyl)methoxy]-4-methoxybenzene
CID 104707496
2-[2-[(2,5-dimethylphenyl)methoxy]-3-methoxyphenyl]ethanamine
CID 61482172
2-[5-fluoro-2-[(2-fluoro-4-methoxyphenyl)methoxy]phenyl]ethanamine
CID 107700182
2-[3-[(2,5-dimethylphenoxy)methyl]-4-methoxyphenyl]ethanamine
CID 170868758
2-[5-methoxy-2-(3-methoxypropoxy)phenyl]ethanamine
CID 54935989
2-[2-(2-methoxyethoxy)-5-methylphenyl]ethanamine
CID 63326313
(1R)-1-[2-[(2,5-dimethylphenyl)methoxy]-4-methoxyphenyl]ethanol
CID 82002762
2-[5-methoxy-2-(thiophen-2-ylmethoxy)phenyl]ethanamine
CID 54931143
2-[2-(2-aminoethyl)-4-methoxyphenoxy]acetonitrile
CID 60905751
2-[2-(2,5-dimethoxyphenyl)-4-methylphenyl]ethanamine
CID 137354597

Frequently Asked Questions

What is the IUPAC name of 2-[2-[(2,5-dimethylphenyl)methoxy]-5-methoxyphenyl]ethanamine?
The IUPAC name of 2-[2-[(2,5-dimethylphenyl)methoxy]-5-methoxyphenyl]ethanamine (CID 61482092) is 2-[2-[(2,5-dimethylphenyl)methoxy]-5-methoxyphenyl]ethanamine.
What is the SMILES notation for 2-[2-[(2,5-dimethylphenyl)methoxy]-5-methoxyphenyl]ethanamine?
The canonical SMILES for 2-[2-[(2,5-dimethylphenyl)methoxy]-5-methoxyphenyl]ethanamine is COc1ccc(OCc2cc(C)ccc2C)c(CCN)c1.
What is the InChIKey of 2-[2-[(2,5-dimethylphenyl)methoxy]-5-methoxyphenyl]ethanamine?
The InChIKey is LTBDYEWCNIODJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23NO2/c1-13-4-5-14(2)16(10-13)12-21-18-7-6-17(20-3)11-15(18)8-9-19/h4-7,10-11H,8-9,12,19H2,1-3H3.
What are the key properties of 2-[2-[(2,5-dimethylphenyl)methoxy]-5-methoxyphenyl]ethanamine?
2-[2-[(2,5-dimethylphenyl)methoxy]-5-methoxyphenyl]ethanamine has a molecular weight of 285.39 g/mol, XLogP of 3.39, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[(2,5-dimethylphenyl)methoxy]-5-methoxyphenyl]ethanamine is sourced from PubChem (CID 61482092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).