2-(2-oxochromen-4-yl)oxy-N-[4-(3-oxomorpholin-4-yl)phenyl]propanamide

C22H20N2O6 — CID 71458539

IUPAC2-(2-oxochromen-4-yl)oxy-N-[4-(3-oxomorpholin-4-yl)phenyl]propanamide
SMILESCC(Oc1cc(=O)oc2ccccc12)C(=O)Nc1ccc(N2CCOCC2=O)cc1
InChIInChI=1S/C22H20N2O6/c1-14(29-19-12-21(26)30-18-5-3-2-4-17(18)19)22(27)23-15-6-8-16(9-7-15)24-10-11-28-13-20(24)25/h2-9,12,14H,10-11,13H2,1H3,(H,23,27)
InChIKeyVLLRZHJEDOOFDB-UHFFFAOYSA-N
MW408.41 g/mol
LogP2.56
Rot. Bonds5

About 2-(2-oxochromen-4-yl)oxy-N-[4-(3-oxomorpholin-4-yl)phenyl]propanamide

2-(2-oxochromen-4-yl)oxy-N-[4-(3-oxomorpholin-4-yl)phenyl]propanamide (PubChem CID 71458539) has the molecular formula C22H20N2O6 and a molecular weight of 408.41 g/mol. Its IUPAC name is 2-(2-oxochromen-4-yl)oxy-N-[4-(3-oxomorpholin-4-yl)phenyl]propanamide.

Molecular Properties

Compound Name2-(2-oxochromen-4-yl)oxy-N-[4-(3-oxomorpholin-4-yl)phenyl]propanamide
PubChem CID71458539
Molecular FormulaC22H20N2O6
Molecular Weight408.41 g/mol
Exact Mass408.13
IUPAC Name2-(2-oxochromen-4-yl)oxy-N-[4-(3-oxomorpholin-4-yl)phenyl]propanamide
SMILESCC(Oc1cc(=O)oc2ccccc12)C(=O)Nc1ccc(N2CCOCC2=O)cc1
InChIInChI=1S/C22H20N2O6/c1-14(29-19-12-21(26)30-18-5-3-2-4-17(18)19)22(27)23-15-6-8-16(9-7-15)24-10-11-28-13-20(24)25/h2-9,12,14H,10-11,13H2,1H3,(H,23,27)
InChIKeyVLLRZHJEDOOFDB-UHFFFAOYSA-N
XLogP2.56
TPSA98.08 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.41
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze 2-(2-oxochromen-4-yl)oxy-N-[4-(3-oxomorpholin-4-yl)phenyl]propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)oxychromen-2-one
CID 71462078
2-amino-4-methyl-N-[4-(3-oxomorpholin-4-yl)phenyl]pentanamide
CID 69060079
2-amino-N-[4-(3-oxomorpholin-4-yl)phenyl]-2-phenylacetamide
CID 69444352
N-(3-chloro-2-methylphenyl)-2-(2-oxochromen-4-yl)oxypropanamide
CID 71462077
(2R)-N-(4-morpholin-4-ylphenyl)-2-[3-(2-oxopyrrolidin-1-yl)phenoxy]propanamide
CID 25408427
ethyl 2-(2-oxochromen-4-yl)oxypropanoate
CID 5135792
(2S)-2-(1-formylnaphthalen-2-yl)oxy-N-(4-morpholin-4-ylphenyl)propanamide
CID 7763394
2-[(2R)-1-(4-morpholin-4-ylanilino)-1-oxopropan-2-yl]oxy-N-phenylbenzamide
CID 41251975
1-(3-chlorophenyl)-3-[4-(3-oxomorpholin-4-yl)phenyl]urea
CID 110363575
4-[4-(propan-2-ylamino)phenyl]morpholin-3-one
CID 70327069
N-dibenzofuran-3-yl-2-(2-methylphenoxy)propanamide
CID 133239743
2-fluoro-N-[4-(3-oxomorpholin-4-yl)phenyl]benzamide
CID 110363540

Frequently Asked Questions

What is the IUPAC name of 2-(2-oxochromen-4-yl)oxy-N-[4-(3-oxomorpholin-4-yl)phenyl]propanamide?
The IUPAC name of 2-(2-oxochromen-4-yl)oxy-N-[4-(3-oxomorpholin-4-yl)phenyl]propanamide (CID 71458539) is 2-(2-oxochromen-4-yl)oxy-N-[4-(3-oxomorpholin-4-yl)phenyl]propanamide.
What is the SMILES notation for 2-(2-oxochromen-4-yl)oxy-N-[4-(3-oxomorpholin-4-yl)phenyl]propanamide?
The canonical SMILES for 2-(2-oxochromen-4-yl)oxy-N-[4-(3-oxomorpholin-4-yl)phenyl]propanamide is CC(Oc1cc(=O)oc2ccccc12)C(=O)Nc1ccc(N2CCOCC2=O)cc1.
What is the InChIKey of 2-(2-oxochromen-4-yl)oxy-N-[4-(3-oxomorpholin-4-yl)phenyl]propanamide?
The InChIKey is VLLRZHJEDOOFDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N2O6/c1-14(29-19-12-21(26)30-18-5-3-2-4-17(18)19)22(27)23-15-6-8-16(9-7-15)24-10-11-28-13-20(24)25/h2-9,12,14H,10-11,13H2,1H3,(H,23,27).
What are the key properties of 2-(2-oxochromen-4-yl)oxy-N-[4-(3-oxomorpholin-4-yl)phenyl]propanamide?
2-(2-oxochromen-4-yl)oxy-N-[4-(3-oxomorpholin-4-yl)phenyl]propanamide has a molecular weight of 408.41 g/mol, XLogP of 2.56, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-oxochromen-4-yl)oxy-N-[4-(3-oxomorpholin-4-yl)phenyl]propanamide is sourced from PubChem (CID 71458539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).