2-(4-methoxyphenyl)-2-morpholin-4-ylethanamine;oxalic acid

C15H22N2O6 — CID 171156320

IUPAC2-(4-methoxyphenyl)-2-morpholin-4-ylethanamine;oxalic acid
SMILESCOc1ccc(C(CN)N2CCOCC2)cc1.O=C(O)C(=O)O
InChIInChI=1S/C13H20N2O2.C2H2O4/c1-16-12-4-2-11(3-5-12)13(10-14)15-6-8-17-9-7-15;3-1(4)2(5)6/h2-5,13H,6-10,14H2,1H3;(H,3,4)(H,5,6)
InChIKeyAPUPWNYDIJMRID-UHFFFAOYSA-N
MW326.35 g/mol
LogP0.18
Rot. Bonds4

About 2-(4-methoxyphenyl)-2-morpholin-4-ylethanamine;oxalic acid

2-(4-methoxyphenyl)-2-morpholin-4-ylethanamine;oxalic acid (PubChem CID 171156320) has the molecular formula C15H22N2O6 and a molecular weight of 326.35 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-2-morpholin-4-ylethanamine;oxalic acid.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-2-morpholin-4-ylethanamine;oxalic acid
PubChem CID171156320
Molecular FormulaC15H22N2O6
Molecular Weight326.35 g/mol
Exact Mass326.15
IUPAC Name2-(4-methoxyphenyl)-2-morpholin-4-ylethanamine;oxalic acid
SMILESCOc1ccc(C(CN)N2CCOCC2)cc1.O=C(O)C(=O)O
InChIInChI=1S/C13H20N2O2.C2H2O4/c1-16-12-4-2-11(3-5-12)13(10-14)15-6-8-17-9-7-15;3-1(4)2(5)6/h2-5,13H,6-10,14H2,1H3;(H,3,4)(H,5,6)
InChIKeyAPUPWNYDIJMRID-UHFFFAOYSA-N
XLogP0.18
TPSA122.32 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.35
LogP ≤ 50.18
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Related Compounds

(3R)-3-(4-methoxyphenyl)-3-morpholin-4-ylpropanoic acid
CID 8022836
3-(4-methoxyphenyl)-3-morpholin-4-ylpropanoic acid
CID 64527154
2-(6-methoxynaphthalen-2-yl)-2-morpholin-4-ylethanamine
CID 16792697
4-(4-methoxyphenyl)-4-morpholin-4-ylbutan-1-amine
CID 112501198
ethyl N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]carbamate
CID 112502614
2-(4-methoxyphenyl)-2-[4-(4-methoxyphenyl)piperazin-1-yl]ethanamine
CID 16642461
(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ylacetamide
CID 92642329
N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]propanamide
CID 43006637
N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-2,2-diphenylacetamide
CID 2467575
(2S)-2-(4-methoxyphenyl)-2-(4-phenylpiperazin-1-yl)ethanamine
CID 9161175
2-(1,1-dioxo-1,4-thiazinan-4-yl)-2-(4-methoxyphenyl)ethanamine
CID 43581263
2-amino-N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-2-methylpropanamide;dihydrochloride
CID 119829745

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-2-morpholin-4-ylethanamine;oxalic acid?
The IUPAC name of 2-(4-methoxyphenyl)-2-morpholin-4-ylethanamine;oxalic acid (CID 171156320) is 2-(4-methoxyphenyl)-2-morpholin-4-ylethanamine;oxalic acid.
What is the SMILES notation for 2-(4-methoxyphenyl)-2-morpholin-4-ylethanamine;oxalic acid?
The canonical SMILES for 2-(4-methoxyphenyl)-2-morpholin-4-ylethanamine;oxalic acid is COc1ccc(C(CN)N2CCOCC2)cc1.O=C(O)C(=O)O.
What is the InChIKey of 2-(4-methoxyphenyl)-2-morpholin-4-ylethanamine;oxalic acid?
The InChIKey is APUPWNYDIJMRID-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2.C2H2O4/c1-16-12-4-2-11(3-5-12)13(10-14)15-6-8-17-9-7-15;3-1(4)2(5)6/h2-5,13H,6-10,14H2,1H3;(H,3,4)(H,5,6).
What are the key properties of 2-(4-methoxyphenyl)-2-morpholin-4-ylethanamine;oxalic acid?
2-(4-methoxyphenyl)-2-morpholin-4-ylethanamine;oxalic acid has a molecular weight of 326.35 g/mol, XLogP of 0.18, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-2-morpholin-4-ylethanamine;oxalic acid is sourced from PubChem (CID 171156320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).