N-(5-methyl-1,2-oxazol-3-yl)-2-(2-oxo-4-propylchromen-7-yl)oxyacetamide

C18H18N2O5 — CID 2090794

IUPACN-(5-methyl-1,2-oxazol-3-yl)-2-(2-oxo-4-propylchromen-7-yl)oxyacetamide
SMILESCCCc1cc(=O)oc2cc(OCC(=O)Nc3cc(C)on3)ccc12
InChIInChI=1S/C18H18N2O5/c1-3-4-12-8-18(22)24-15-9-13(5-6-14(12)15)23-10-17(21)19-16-7-11(2)25-20-16/h5-9H,3-4,10H2,1-2H3,(H,19,20,21)
InChIKeyIDKXYAANQNIGKA-UHFFFAOYSA-N
MW342.35 g/mol
LogP3.06
Rot. Bonds6

About N-(5-methyl-1,2-oxazol-3-yl)-2-(2-oxo-4-propylchromen-7-yl)oxyacetamide

N-(5-methyl-1,2-oxazol-3-yl)-2-(2-oxo-4-propylchromen-7-yl)oxyacetamide (PubChem CID 2090794) has the molecular formula C18H18N2O5 and a molecular weight of 342.35 g/mol. Its IUPAC name is N-(5-methyl-1,2-oxazol-3-yl)-2-(2-oxo-4-propylchromen-7-yl)oxyacetamide.

Molecular Properties

Compound NameN-(5-methyl-1,2-oxazol-3-yl)-2-(2-oxo-4-propylchromen-7-yl)oxyacetamide
PubChem CID2090794
Molecular FormulaC18H18N2O5
Molecular Weight342.35 g/mol
Exact Mass342.12
IUPAC NameN-(5-methyl-1,2-oxazol-3-yl)-2-(2-oxo-4-propylchromen-7-yl)oxyacetamide
SMILESCCCc1cc(=O)oc2cc(OCC(=O)Nc3cc(C)on3)ccc12
InChIInChI=1S/C18H18N2O5/c1-3-4-12-8-18(22)24-15-9-13(5-6-14(12)15)23-10-17(21)19-16-7-11(2)25-20-16/h5-9H,3-4,10H2,1-2H3,(H,19,20,21)
InChIKeyIDKXYAANQNIGKA-UHFFFAOYSA-N
XLogP3.06
TPSA94.57 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.35
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze N-(5-methyl-1,2-oxazol-3-yl)-2-(2-oxo-4-propylchromen-7-yl)oxyacetamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-1,2-oxazol-3-yl)-2-(2-oxo-4-propylchromen-7-yl)oxyacetamide?
The IUPAC name of N-(5-methyl-1,2-oxazol-3-yl)-2-(2-oxo-4-propylchromen-7-yl)oxyacetamide (CID 2090794) is N-(5-methyl-1,2-oxazol-3-yl)-2-(2-oxo-4-propylchromen-7-yl)oxyacetamide.
What is the SMILES notation for N-(5-methyl-1,2-oxazol-3-yl)-2-(2-oxo-4-propylchromen-7-yl)oxyacetamide?
The canonical SMILES for N-(5-methyl-1,2-oxazol-3-yl)-2-(2-oxo-4-propylchromen-7-yl)oxyacetamide is CCCc1cc(=O)oc2cc(OCC(=O)Nc3cc(C)on3)ccc12.
What is the InChIKey of N-(5-methyl-1,2-oxazol-3-yl)-2-(2-oxo-4-propylchromen-7-yl)oxyacetamide?
The InChIKey is IDKXYAANQNIGKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O5/c1-3-4-12-8-18(22)24-15-9-13(5-6-14(12)15)23-10-17(21)19-16-7-11(2)25-20-16/h5-9H,3-4,10H2,1-2H3,(H,19,20,21).
What are the key properties of N-(5-methyl-1,2-oxazol-3-yl)-2-(2-oxo-4-propylchromen-7-yl)oxyacetamide?
N-(5-methyl-1,2-oxazol-3-yl)-2-(2-oxo-4-propylchromen-7-yl)oxyacetamide has a molecular weight of 342.35 g/mol, XLogP of 3.06, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-1,2-oxazol-3-yl)-2-(2-oxo-4-propylchromen-7-yl)oxyacetamide is sourced from PubChem (CID 2090794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).