3-(5-propan-2-ylpyrimidin-2-yl)-1,3-oxazolidin-2-one

C10H13N3O2 — CID 177130197

IUPAC3-(5-propan-2-ylpyrimidin-2-yl)-1,3-oxazolidin-2-one
SMILESCC(C)c1cnc(N2CCOC2=O)nc1
InChIInChI=1S/C10H13N3O2/c1-7(2)8-5-11-9(12-6-8)13-3-4-15-10(13)14/h5-7H,3-4H2,1-2H3
InChIKeyHEUUSCJUWCHAIW-UHFFFAOYSA-N
MW207.23 g/mol
LogP1.56
Rot. Bonds2

About 3-(5-propan-2-ylpyrimidin-2-yl)-1,3-oxazolidin-2-one

3-(5-propan-2-ylpyrimidin-2-yl)-1,3-oxazolidin-2-one (PubChem CID 177130197) has the molecular formula C10H13N3O2 and a molecular weight of 207.23 g/mol. Its IUPAC name is 3-(5-propan-2-ylpyrimidin-2-yl)-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name3-(5-propan-2-ylpyrimidin-2-yl)-1,3-oxazolidin-2-one
PubChem CID177130197
Molecular FormulaC10H13N3O2
Molecular Weight207.23 g/mol
Exact Mass207.10
IUPAC Name3-(5-propan-2-ylpyrimidin-2-yl)-1,3-oxazolidin-2-one
SMILESCC(C)c1cnc(N2CCOC2=O)nc1
InChIInChI=1S/C10H13N3O2/c1-7(2)8-5-11-9(12-6-8)13-3-4-15-10(13)14/h5-7H,3-4H2,1-2H3
InChIKeyHEUUSCJUWCHAIW-UHFFFAOYSA-N
XLogP1.56
TPSA55.32 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.23
LogP ≤ 51.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(5-propan-2-ylpyrimidin-2-yl)-1,3-oxazolidin-2-one?
The IUPAC name of 3-(5-propan-2-ylpyrimidin-2-yl)-1,3-oxazolidin-2-one (CID 177130197) is 3-(5-propan-2-ylpyrimidin-2-yl)-1,3-oxazolidin-2-one.
What is the SMILES notation for 3-(5-propan-2-ylpyrimidin-2-yl)-1,3-oxazolidin-2-one?
The canonical SMILES for 3-(5-propan-2-ylpyrimidin-2-yl)-1,3-oxazolidin-2-one is CC(C)c1cnc(N2CCOC2=O)nc1.
What is the InChIKey of 3-(5-propan-2-ylpyrimidin-2-yl)-1,3-oxazolidin-2-one?
The InChIKey is HEUUSCJUWCHAIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O2/c1-7(2)8-5-11-9(12-6-8)13-3-4-15-10(13)14/h5-7H,3-4H2,1-2H3.
What are the key properties of 3-(5-propan-2-ylpyrimidin-2-yl)-1,3-oxazolidin-2-one?
3-(5-propan-2-ylpyrimidin-2-yl)-1,3-oxazolidin-2-one has a molecular weight of 207.23 g/mol, XLogP of 1.56, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-propan-2-ylpyrimidin-2-yl)-1,3-oxazolidin-2-one is sourced from PubChem (CID 177130197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).