2-(1,3-benzodioxol-5-yloxy)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide

C20H20N2O6 — CID 17310325

IUPAC2-(1,3-benzodioxol-5-yloxy)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide
SMILESO=C(COc1ccc2c(c1)OCO2)Nc1ccccc1C(=O)N1CCOCC1
InChIInChI=1S/C20H20N2O6/c23-19(12-26-14-5-6-17-18(11-14)28-13-27-17)21-16-4-2-1-3-15(16)20(24)22-7-9-25-10-8-22/h1-6,11H,7-10,12-13H2,(H,21,23)
InChIKeyNRMISOZWMYIWEM-UHFFFAOYSA-N
MW384.39 g/mol
LogP1.91
Rot. Bonds5

About 2-(1,3-benzodioxol-5-yloxy)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide

2-(1,3-benzodioxol-5-yloxy)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide (PubChem CID 17310325) has the molecular formula C20H20N2O6 and a molecular weight of 384.39 g/mol. Its IUPAC name is 2-(1,3-benzodioxol-5-yloxy)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide.

Molecular Properties

Compound Name2-(1,3-benzodioxol-5-yloxy)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide
PubChem CID17310325
Molecular FormulaC20H20N2O6
Molecular Weight384.39 g/mol
Exact Mass384.13
IUPAC Name2-(1,3-benzodioxol-5-yloxy)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide
SMILESO=C(COc1ccc2c(c1)OCO2)Nc1ccccc1C(=O)N1CCOCC1
InChIInChI=1S/C20H20N2O6/c23-19(12-26-14-5-6-17-18(11-14)28-13-27-17)21-16-4-2-1-3-15(16)20(24)22-7-9-25-10-8-22/h1-6,11H,7-10,12-13H2,(H,21,23)
InChIKeyNRMISOZWMYIWEM-UHFFFAOYSA-N
XLogP1.91
TPSA86.33 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.39
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-[[2-(1,3-benzodioxol-5-yloxy)acetyl]amino]benzamide
CID 6493270
2-(3-methyl-4-propan-2-ylphenoxy)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide
CID 35326706
ethyl 2-[[2-(1,3-benzodioxol-5-yloxy)acetyl]amino]benzoate
CID 17310220
2-[1,3-benzodioxol-5-yl(ethylsulfonyl)amino]-N-[2-(morpholine-4-carbonyl)phenyl]acetamide
CID 21368234
2-(2-bromo-4-phenylphenoxy)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide
CID 4960710
N,N'-bis[2-(morpholine-4-carbonyl)phenyl]decanediamide
CID 17080133
2-phenoxy-N-[2-(4-phenylpiperazine-1-carbonyl)phenyl]acetamide
CID 17018898
2-(1,3-benzodioxol-5-yloxy)-N-(4-morpholin-4-ylsulfonylphenyl)acetamide
CID 17310285
2-(3-methylphenoxy)-N-[2-(pyrrolidine-1-carbonyl)phenyl]acetamide
CID 4932419
2-(6-bromonaphthalen-2-yl)oxy-N-[2-(piperidine-1-carbonyl)phenyl]acetamide
CID 55770978
2-(4-methylphenoxy)-N-[2-(piperidine-1-carbonyl)phenyl]acetamide
CID 4935995
2-(3,5-dimethylphenoxy)-N-[2-(pyrrolidine-1-carbonyl)phenyl]acetamide
CID 4932401

Frequently Asked Questions

What is the IUPAC name of 2-(1,3-benzodioxol-5-yloxy)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide?
The IUPAC name of 2-(1,3-benzodioxol-5-yloxy)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide (CID 17310325) is 2-(1,3-benzodioxol-5-yloxy)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide.
What is the SMILES notation for 2-(1,3-benzodioxol-5-yloxy)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide?
The canonical SMILES for 2-(1,3-benzodioxol-5-yloxy)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide is O=C(COc1ccc2c(c1)OCO2)Nc1ccccc1C(=O)N1CCOCC1.
What is the InChIKey of 2-(1,3-benzodioxol-5-yloxy)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide?
The InChIKey is NRMISOZWMYIWEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O6/c23-19(12-26-14-5-6-17-18(11-14)28-13-27-17)21-16-4-2-1-3-15(16)20(24)22-7-9-25-10-8-22/h1-6,11H,7-10,12-13H2,(H,21,23).
What are the key properties of 2-(1,3-benzodioxol-5-yloxy)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide?
2-(1,3-benzodioxol-5-yloxy)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide has a molecular weight of 384.39 g/mol, XLogP of 1.91, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,3-benzodioxol-5-yloxy)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide is sourced from PubChem (CID 17310325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).