2-methyl-N-[2-oxo-2-(propylamino)ethyl]-1,3-oxazole-4-carboxamide

C10H15N3O3 — CID 99787077

IUPAC2-methyl-N-[2-oxo-2-(propylamino)ethyl]-1,3-oxazole-4-carboxamide
SMILESCCCNC(=O)CNC(=O)c1coc(C)n1
InChIInChI=1S/C10H15N3O3/c1-3-4-11-9(14)5-12-10(15)8-6-16-7(2)13-8/h6H,3-5H2,1-2H3,(H,11,14)(H,12,15)
InChIKeyLEWGLOFEPMILSR-UHFFFAOYSA-N
MW225.25 g/mol
LogP0.24
Rot. Bonds5

About 2-methyl-N-[2-oxo-2-(propylamino)ethyl]-1,3-oxazole-4-carboxamide

2-methyl-N-[2-oxo-2-(propylamino)ethyl]-1,3-oxazole-4-carboxamide (PubChem CID 99787077) has the molecular formula C10H15N3O3 and a molecular weight of 225.25 g/mol. Its IUPAC name is 2-methyl-N-[2-oxo-2-(propylamino)ethyl]-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound Name2-methyl-N-[2-oxo-2-(propylamino)ethyl]-1,3-oxazole-4-carboxamide
PubChem CID99787077
Molecular FormulaC10H15N3O3
Molecular Weight225.25 g/mol
Exact Mass225.11
IUPAC Name2-methyl-N-[2-oxo-2-(propylamino)ethyl]-1,3-oxazole-4-carboxamide
SMILESCCCNC(=O)CNC(=O)c1coc(C)n1
InChIInChI=1S/C10H15N3O3/c1-3-4-11-9(14)5-12-10(15)8-6-16-7(2)13-8/h6H,3-5H2,1-2H3,(H,11,14)(H,12,15)
InChIKeyLEWGLOFEPMILSR-UHFFFAOYSA-N
XLogP0.24
TPSA84.23 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.25
LogP ≤ 50.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[2-oxo-2-(propylamino)ethyl]-1,3-oxazole-4-carboxamide?
The IUPAC name of 2-methyl-N-[2-oxo-2-(propylamino)ethyl]-1,3-oxazole-4-carboxamide (CID 99787077) is 2-methyl-N-[2-oxo-2-(propylamino)ethyl]-1,3-oxazole-4-carboxamide.
What is the SMILES notation for 2-methyl-N-[2-oxo-2-(propylamino)ethyl]-1,3-oxazole-4-carboxamide?
The canonical SMILES for 2-methyl-N-[2-oxo-2-(propylamino)ethyl]-1,3-oxazole-4-carboxamide is CCCNC(=O)CNC(=O)c1coc(C)n1.
What is the InChIKey of 2-methyl-N-[2-oxo-2-(propylamino)ethyl]-1,3-oxazole-4-carboxamide?
The InChIKey is LEWGLOFEPMILSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O3/c1-3-4-11-9(14)5-12-10(15)8-6-16-7(2)13-8/h6H,3-5H2,1-2H3,(H,11,14)(H,12,15).
What are the key properties of 2-methyl-N-[2-oxo-2-(propylamino)ethyl]-1,3-oxazole-4-carboxamide?
2-methyl-N-[2-oxo-2-(propylamino)ethyl]-1,3-oxazole-4-carboxamide has a molecular weight of 225.25 g/mol, XLogP of 0.24, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[2-oxo-2-(propylamino)ethyl]-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 99787077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).