N-methyl-N-[1-(1,2-oxazol-3-yl)ethyl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide

C11H15N3O4 — CID 72895726

IUPACN-methyl-N-[1-(1,2-oxazol-3-yl)ethyl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide
SMILESCC(c1ccon1)N(C)C(=O)CN1CCOC1=O
InChIInChI=1S/C11H15N3O4/c1-8(9-3-5-18-12-9)13(2)10(15)7-14-4-6-17-11(14)16/h3,5,8H,4,6-7H2,1-2H3
InChIKeyVGLKXGZHXSYDBH-UHFFFAOYSA-N
MW253.26 g/mol
LogP0.65
Rot. Bonds4

About N-methyl-N-[1-(1,2-oxazol-3-yl)ethyl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide

N-methyl-N-[1-(1,2-oxazol-3-yl)ethyl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide (PubChem CID 72895726) has the molecular formula C11H15N3O4 and a molecular weight of 253.26 g/mol. Its IUPAC name is N-methyl-N-[1-(1,2-oxazol-3-yl)ethyl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide.

Molecular Properties

Compound NameN-methyl-N-[1-(1,2-oxazol-3-yl)ethyl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide
PubChem CID72895726
Molecular FormulaC11H15N3O4
Molecular Weight253.26 g/mol
Exact Mass253.11
IUPAC NameN-methyl-N-[1-(1,2-oxazol-3-yl)ethyl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide
SMILESCC(c1ccon1)N(C)C(=O)CN1CCOC1=O
InChIInChI=1S/C11H15N3O4/c1-8(9-3-5-18-12-9)13(2)10(15)7-14-4-6-17-11(14)16/h3,5,8H,4,6-7H2,1-2H3
InChIKeyVGLKXGZHXSYDBH-UHFFFAOYSA-N
XLogP0.65
TPSA75.88 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.26
LogP ≤ 50.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[1-(1,2-oxazol-3-yl)ethyl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide?
The IUPAC name of N-methyl-N-[1-(1,2-oxazol-3-yl)ethyl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide (CID 72895726) is N-methyl-N-[1-(1,2-oxazol-3-yl)ethyl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide.
What is the SMILES notation for N-methyl-N-[1-(1,2-oxazol-3-yl)ethyl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide?
The canonical SMILES for N-methyl-N-[1-(1,2-oxazol-3-yl)ethyl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide is CC(c1ccon1)N(C)C(=O)CN1CCOC1=O.
What is the InChIKey of N-methyl-N-[1-(1,2-oxazol-3-yl)ethyl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide?
The InChIKey is VGLKXGZHXSYDBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O4/c1-8(9-3-5-18-12-9)13(2)10(15)7-14-4-6-17-11(14)16/h3,5,8H,4,6-7H2,1-2H3.
What are the key properties of N-methyl-N-[1-(1,2-oxazol-3-yl)ethyl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide?
N-methyl-N-[1-(1,2-oxazol-3-yl)ethyl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide has a molecular weight of 253.26 g/mol, XLogP of 0.65, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[1-(1,2-oxazol-3-yl)ethyl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide is sourced from PubChem (CID 72895726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).