3-pyridin-3-yl-1,3-oxazolidin-2-one

C8H8N2O2 — CID 556038

IUPAC3-pyridin-3-yl-1,3-oxazolidin-2-one
SMILESO=C1OCCN1c1cccnc1
InChIInChI=1S/C8H8N2O2/c11-8-10(4-5-12-8)7-2-1-3-9-6-7/h1-3,6H,4-5H2
InChIKeyYVVGTEAJAWXRGT-UHFFFAOYSA-N
MW164.16 g/mol
LogP1.04
Rot. Bonds1

About 3-pyridin-3-yl-1,3-oxazolidin-2-one

3-pyridin-3-yl-1,3-oxazolidin-2-one (PubChem CID 556038) has the molecular formula C8H8N2O2 and a molecular weight of 164.16 g/mol. Its IUPAC name is 3-pyridin-3-yl-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name3-pyridin-3-yl-1,3-oxazolidin-2-one
PubChem CID556038
Molecular FormulaC8H8N2O2
Molecular Weight164.16 g/mol
Exact Mass164.06
IUPAC Name3-pyridin-3-yl-1,3-oxazolidin-2-one
SMILESO=C1OCCN1c1cccnc1
InChIInChI=1S/C8H8N2O2/c11-8-10(4-5-12-8)7-2-1-3-9-6-7/h1-3,6H,4-5H2
InChIKeyYVVGTEAJAWXRGT-UHFFFAOYSA-N
XLogP1.04
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.16
LogP ≤ 51.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-pyridin-3-yl-1,3-oxazolidin-2-one?
The IUPAC name of 3-pyridin-3-yl-1,3-oxazolidin-2-one (CID 556038) is 3-pyridin-3-yl-1,3-oxazolidin-2-one.
What is the SMILES notation for 3-pyridin-3-yl-1,3-oxazolidin-2-one?
The canonical SMILES for 3-pyridin-3-yl-1,3-oxazolidin-2-one is O=C1OCCN1c1cccnc1.
What is the InChIKey of 3-pyridin-3-yl-1,3-oxazolidin-2-one?
The InChIKey is YVVGTEAJAWXRGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N2O2/c11-8-10(4-5-12-8)7-2-1-3-9-6-7/h1-3,6H,4-5H2.
What are the key properties of 3-pyridin-3-yl-1,3-oxazolidin-2-one?
3-pyridin-3-yl-1,3-oxazolidin-2-one has a molecular weight of 164.16 g/mol, XLogP of 1.04, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-pyridin-3-yl-1,3-oxazolidin-2-one is sourced from PubChem (CID 556038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).