2-(2,5-dimethoxyphenyl)-2-(3-methylmorpholin-4-yl)ethanamine

C15H24N2O3 — CID 43541870

IUPAC2-(2,5-dimethoxyphenyl)-2-(3-methylmorpholin-4-yl)ethanamine
SMILESCOc1ccc(OC)c(C(CN)N2CCOCC2C)c1
InChIInChI=1S/C15H24N2O3/c1-11-10-20-7-6-17(11)14(9-16)13-8-12(18-2)4-5-15(13)19-3/h4-5,8,11,14H,6-7,9-10,16H2,1-3H3
InChIKeyOYDCWWYPPTXAJB-UHFFFAOYSA-N
MW280.37 g/mol
LogP1.42
Rot. Bonds5

About 2-(2,5-dimethoxyphenyl)-2-(3-methylmorpholin-4-yl)ethanamine

2-(2,5-dimethoxyphenyl)-2-(3-methylmorpholin-4-yl)ethanamine (PubChem CID 43541870) has the molecular formula C15H24N2O3 and a molecular weight of 280.37 g/mol. Its IUPAC name is 2-(2,5-dimethoxyphenyl)-2-(3-methylmorpholin-4-yl)ethanamine.

Molecular Properties

Compound Name2-(2,5-dimethoxyphenyl)-2-(3-methylmorpholin-4-yl)ethanamine
PubChem CID43541870
Molecular FormulaC15H24N2O3
Molecular Weight280.37 g/mol
Exact Mass280.18
IUPAC Name2-(2,5-dimethoxyphenyl)-2-(3-methylmorpholin-4-yl)ethanamine
SMILESCOc1ccc(OC)c(C(CN)N2CCOCC2C)c1
InChIInChI=1S/C15H24N2O3/c1-11-10-20-7-6-17(11)14(9-16)13-8-12(18-2)4-5-15(13)19-3/h4-5,8,11,14H,6-7,9-10,16H2,1-3H3
InChIKeyOYDCWWYPPTXAJB-UHFFFAOYSA-N
XLogP1.42
TPSA56.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethoxyphenyl)-2-(3-methylmorpholin-4-yl)ethanamine?
The IUPAC name of 2-(2,5-dimethoxyphenyl)-2-(3-methylmorpholin-4-yl)ethanamine (CID 43541870) is 2-(2,5-dimethoxyphenyl)-2-(3-methylmorpholin-4-yl)ethanamine.
What is the SMILES notation for 2-(2,5-dimethoxyphenyl)-2-(3-methylmorpholin-4-yl)ethanamine?
The canonical SMILES for 2-(2,5-dimethoxyphenyl)-2-(3-methylmorpholin-4-yl)ethanamine is COc1ccc(OC)c(C(CN)N2CCOCC2C)c1.
What is the InChIKey of 2-(2,5-dimethoxyphenyl)-2-(3-methylmorpholin-4-yl)ethanamine?
The InChIKey is OYDCWWYPPTXAJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O3/c1-11-10-20-7-6-17(11)14(9-16)13-8-12(18-2)4-5-15(13)19-3/h4-5,8,11,14H,6-7,9-10,16H2,1-3H3.
What are the key properties of 2-(2,5-dimethoxyphenyl)-2-(3-methylmorpholin-4-yl)ethanamine?
2-(2,5-dimethoxyphenyl)-2-(3-methylmorpholin-4-yl)ethanamine has a molecular weight of 280.37 g/mol, XLogP of 1.42, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethoxyphenyl)-2-(3-methylmorpholin-4-yl)ethanamine is sourced from PubChem (CID 43541870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).