2-(2,3-dimethylphenoxy)-1-(2-methoxy-5-methylphenyl)ethanamine

C18H23NO2 — CID 43101312

IUPAC2-(2,3-dimethylphenoxy)-1-(2-methoxy-5-methylphenyl)ethanamine
SMILESCOc1ccc(C)cc1C(N)COc1cccc(C)c1C
InChIInChI=1S/C18H23NO2/c1-12-8-9-18(20-4)15(10-12)16(19)11-21-17-7-5-6-13(2)14(17)3/h5-10,16H,11,19H2,1-4H3
InChIKeyJUXOWVOYDIJQMX-UHFFFAOYSA-N
MW285.39 g/mol
LogP3.70
Rot. Bonds5

About 2-(2,3-dimethylphenoxy)-1-(2-methoxy-5-methylphenyl)ethanamine

2-(2,3-dimethylphenoxy)-1-(2-methoxy-5-methylphenyl)ethanamine (PubChem CID 43101312) has the molecular formula C18H23NO2 and a molecular weight of 285.39 g/mol. Its IUPAC name is 2-(2,3-dimethylphenoxy)-1-(2-methoxy-5-methylphenyl)ethanamine.

Molecular Properties

Compound Name2-(2,3-dimethylphenoxy)-1-(2-methoxy-5-methylphenyl)ethanamine
PubChem CID43101312
Molecular FormulaC18H23NO2
Molecular Weight285.39 g/mol
Exact Mass285.17
IUPAC Name2-(2,3-dimethylphenoxy)-1-(2-methoxy-5-methylphenyl)ethanamine
SMILESCOc1ccc(C)cc1C(N)COc1cccc(C)c1C
InChIInChI=1S/C18H23NO2/c1-12-8-9-18(20-4)15(10-12)16(19)11-21-17-7-5-6-13(2)14(17)3/h5-10,16H,11,19H2,1-4H3
InChIKeyJUXOWVOYDIJQMX-UHFFFAOYSA-N
XLogP3.70
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-methoxy-5-methylphenyl)-2-(2-methoxyphenoxy)ethanamine
CID 16785142
1-(2-methoxyphenyl)-2-(2,4,6-trimethylphenoxy)ethanamine
CID 61220878
(2S)-2-amino-2-(2-methoxy-5-methylphenyl)ethanol
CID 55278412
1-(2-methoxy-5-methylphenyl)-2-(2-methylphenyl)sulfanylethanamine
CID 64649874
1-(2,2-dimethoxyethoxy)-2,3-dimethylbenzene
CID 4198790
2-(2,6-dimethylphenoxy)-1-(2,5-dimethylphenyl)ethanamine
CID 43093894
(1R)-1-(2-methoxy-5-methylphenyl)butan-1-amine
CID 55278250
(2,6-dimethoxyphenyl)-(2-methoxy-5-methylphenyl)methanamine
CID 43626072
1-(2-methoxy-5-methylphenyl)-2-(4-methylpentan-2-yloxy)ethanamine
CID 43183961
2-(2-fluoro-5-methylphenoxy)-1-(2-methylphenyl)ethanamine
CID 64853630
1-(2-methoxy-5-methylphenyl)-2-[(2-methylphenyl)methylsulfanyl]ethanamine
CID 64634603
3-amino-3-(2-methoxy-5-methylphenyl)propanehydrazide
CID 116848730

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dimethylphenoxy)-1-(2-methoxy-5-methylphenyl)ethanamine?
The IUPAC name of 2-(2,3-dimethylphenoxy)-1-(2-methoxy-5-methylphenyl)ethanamine (CID 43101312) is 2-(2,3-dimethylphenoxy)-1-(2-methoxy-5-methylphenyl)ethanamine.
What is the SMILES notation for 2-(2,3-dimethylphenoxy)-1-(2-methoxy-5-methylphenyl)ethanamine?
The canonical SMILES for 2-(2,3-dimethylphenoxy)-1-(2-methoxy-5-methylphenyl)ethanamine is COc1ccc(C)cc1C(N)COc1cccc(C)c1C.
What is the InChIKey of 2-(2,3-dimethylphenoxy)-1-(2-methoxy-5-methylphenyl)ethanamine?
The InChIKey is JUXOWVOYDIJQMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23NO2/c1-12-8-9-18(20-4)15(10-12)16(19)11-21-17-7-5-6-13(2)14(17)3/h5-10,16H,11,19H2,1-4H3.
What are the key properties of 2-(2,3-dimethylphenoxy)-1-(2-methoxy-5-methylphenyl)ethanamine?
2-(2,3-dimethylphenoxy)-1-(2-methoxy-5-methylphenyl)ethanamine has a molecular weight of 285.39 g/mol, XLogP of 3.70, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dimethylphenoxy)-1-(2-methoxy-5-methylphenyl)ethanamine is sourced from PubChem (CID 43101312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).