3-(2-aminophenoxy)-N-[(4-methylmorpholin-2-yl)methyl]propanamide

C15H23N3O3 — CID 79079684

IUPAC3-(2-aminophenoxy)-N-[(4-methylmorpholin-2-yl)methyl]propanamide
SMILESCN1CCOC(CNC(=O)CCOc2ccccc2N)C1
InChIInChI=1S/C15H23N3O3/c1-18-7-9-20-12(11-18)10-17-15(19)6-8-21-14-5-3-2-4-13(14)16/h2-5,12H,6-11,16H2,1H3,(H,17,19)
InChIKeyZBDLOSMNTGLESA-UHFFFAOYSA-N
MW293.37 g/mol
LogP0.48
Rot. Bonds6

About 3-(2-aminophenoxy)-N-[(4-methylmorpholin-2-yl)methyl]propanamide

3-(2-aminophenoxy)-N-[(4-methylmorpholin-2-yl)methyl]propanamide (PubChem CID 79079684) has the molecular formula C15H23N3O3 and a molecular weight of 293.37 g/mol. Its IUPAC name is 3-(2-aminophenoxy)-N-[(4-methylmorpholin-2-yl)methyl]propanamide.

Molecular Properties

Compound Name3-(2-aminophenoxy)-N-[(4-methylmorpholin-2-yl)methyl]propanamide
PubChem CID79079684
Molecular FormulaC15H23N3O3
Molecular Weight293.37 g/mol
Exact Mass293.17
IUPAC Name3-(2-aminophenoxy)-N-[(4-methylmorpholin-2-yl)methyl]propanamide
SMILESCN1CCOC(CNC(=O)CCOc2ccccc2N)C1
InChIInChI=1S/C15H23N3O3/c1-18-7-9-20-12(11-18)10-17-15(19)6-8-21-14-5-3-2-4-13(14)16/h2-5,12H,6-11,16H2,1H3,(H,17,19)
InChIKeyZBDLOSMNTGLESA-UHFFFAOYSA-N
XLogP0.48
TPSA76.82 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 50.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

(4-methylmorpholin-2-yl)methyl 2-(2-aminophenoxy)acetate
CID 79183171
N-[(4-methylmorpholin-2-yl)methyl]-2-phenylacetamide
CID 110710224
N-[(4-methylmorpholin-2-yl)methyl]-3,3-diphenylpropanamide
CID 49094292
2,6-dimethoxy-N-[(4-methylmorpholin-2-yl)methyl]benzamide
CID 110710223
N-[(4-methylmorpholin-2-yl)methyl]-3-thiophen-2-ylpropanamide
CID 110710235
N-[[(2S)-4-methylmorpholin-2-yl]methyl]-3-(5-phenyl-1,3-oxazol-2-yl)propanamide
CID 94793728
N-[[(2R)-4-methylmorpholin-2-yl]methyl]-3-(5-phenyl-1,3-oxazol-2-yl)propanamide
CID 94793725
2-(2-aminophenoxy)-N-[(1-methylpyrrolidin-3-yl)methyl]acetamide
CID 60855037
2-(2-chlorophenyl)-N-[(4-methylmorpholin-2-yl)methyl]acetamide
CID 49093905
3-(2-aminophenoxy)-N-morpholin-4-ylpropanamide
CID 83013203
N-[(4-methylmorpholin-2-yl)methyl]-2-naphthalen-2-ylacetamide
CID 49094018
(2R)-2-(2-chlorophenoxy)-N-[[(2R)-4-methylmorpholin-2-yl]methyl]propanamide
CID 94815626

Frequently Asked Questions

What is the IUPAC name of 3-(2-aminophenoxy)-N-[(4-methylmorpholin-2-yl)methyl]propanamide?
The IUPAC name of 3-(2-aminophenoxy)-N-[(4-methylmorpholin-2-yl)methyl]propanamide (CID 79079684) is 3-(2-aminophenoxy)-N-[(4-methylmorpholin-2-yl)methyl]propanamide.
What is the SMILES notation for 3-(2-aminophenoxy)-N-[(4-methylmorpholin-2-yl)methyl]propanamide?
The canonical SMILES for 3-(2-aminophenoxy)-N-[(4-methylmorpholin-2-yl)methyl]propanamide is CN1CCOC(CNC(=O)CCOc2ccccc2N)C1.
What is the InChIKey of 3-(2-aminophenoxy)-N-[(4-methylmorpholin-2-yl)methyl]propanamide?
The InChIKey is ZBDLOSMNTGLESA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O3/c1-18-7-9-20-12(11-18)10-17-15(19)6-8-21-14-5-3-2-4-13(14)16/h2-5,12H,6-11,16H2,1H3,(H,17,19).
What are the key properties of 3-(2-aminophenoxy)-N-[(4-methylmorpholin-2-yl)methyl]propanamide?
3-(2-aminophenoxy)-N-[(4-methylmorpholin-2-yl)methyl]propanamide has a molecular weight of 293.37 g/mol, XLogP of 0.48, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-aminophenoxy)-N-[(4-methylmorpholin-2-yl)methyl]propanamide is sourced from PubChem (CID 79079684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).