1-(1,3-oxazol-2-yl)-5-oxopyrrolidine-3-carboxamide

C8H9N3O3 — CID 168698612

IUPAC1-(1,3-oxazol-2-yl)-5-oxopyrrolidine-3-carboxamide
SMILESNC(=O)C1CC(=O)N(c2ncco2)C1
InChIInChI=1S/C8H9N3O3/c9-7(13)5-3-6(12)11(4-5)8-10-1-2-14-8/h1-2,5H,3-4H2,(H2,9,13)
InChIKeyGLQLSPXDBDMCBE-UHFFFAOYSA-N
MW195.18 g/mol
LogP-0.49
Rot. Bonds2

About 1-(1,3-oxazol-2-yl)-5-oxopyrrolidine-3-carboxamide

1-(1,3-oxazol-2-yl)-5-oxopyrrolidine-3-carboxamide (PubChem CID 168698612) has the molecular formula C8H9N3O3 and a molecular weight of 195.18 g/mol. Its IUPAC name is 1-(1,3-oxazol-2-yl)-5-oxopyrrolidine-3-carboxamide.

Molecular Properties

Compound Name1-(1,3-oxazol-2-yl)-5-oxopyrrolidine-3-carboxamide
PubChem CID168698612
Molecular FormulaC8H9N3O3
Molecular Weight195.18 g/mol
Exact Mass195.06
IUPAC Name1-(1,3-oxazol-2-yl)-5-oxopyrrolidine-3-carboxamide
SMILESNC(=O)C1CC(=O)N(c2ncco2)C1
InChIInChI=1S/C8H9N3O3/c9-7(13)5-3-6(12)11(4-5)8-10-1-2-14-8/h1-2,5H,3-4H2,(H2,9,13)
InChIKeyGLQLSPXDBDMCBE-UHFFFAOYSA-N
XLogP-0.49
TPSA89.43 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.18
LogP ≤ 5-0.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-oxo-1-pyrazin-2-ylpyrrolidine-3-carboxamide
CID 168698605
1-(3-amino-5-bromopyrazin-2-yl)-5-oxopyrrolidine-3-carboxamide
CID 168698071
1-(5-fluoro-2-pyridinyl)-5-oxopyrrolidine-3-carboxamide
CID 168697887
1-(3,5-dichloro-2-pyridinyl)-5-oxopyrrolidine-3-carboxamide
CID 168698108
5-oxo-1-(1H-1,2,4-triazol-5-yl)pyrrolidine-3-carboxamide
CID 168698653
1-(2-bromo-3-pyridinyl)-5-oxopyrrolidine-3-carboxamide
CID 168698437
1-(5-bromopyrimidin-4-yl)-5-oxopyrrolidine-3-carboxamide
CID 168698124
1-(3,5-dimethyl-2-pyridinyl)-5-oxopyrrolidine-3-carboxamide
CID 168696816
1-(4-aminophenyl)-5-oxopyrrolidine-3-carboxamide
CID 168697847
1-[4-(1,3-oxazol-5-yl)phenyl]-5-oxopyrrolidine-3-carboxamide
CID 168697831
methyl 2-(4-carbamoyl-2-oxopyrrolidin-1-yl)pyrimidine-5-carboxylate
CID 168696464
1-(4-formyl-3-pyridinyl)-5-oxopyrrolidine-3-carboxamide
CID 168698152

Frequently Asked Questions

What is the IUPAC name of 1-(1,3-oxazol-2-yl)-5-oxopyrrolidine-3-carboxamide?
The IUPAC name of 1-(1,3-oxazol-2-yl)-5-oxopyrrolidine-3-carboxamide (CID 168698612) is 1-(1,3-oxazol-2-yl)-5-oxopyrrolidine-3-carboxamide.
What is the SMILES notation for 1-(1,3-oxazol-2-yl)-5-oxopyrrolidine-3-carboxamide?
The canonical SMILES for 1-(1,3-oxazol-2-yl)-5-oxopyrrolidine-3-carboxamide is NC(=O)C1CC(=O)N(c2ncco2)C1.
What is the InChIKey of 1-(1,3-oxazol-2-yl)-5-oxopyrrolidine-3-carboxamide?
The InChIKey is GLQLSPXDBDMCBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N3O3/c9-7(13)5-3-6(12)11(4-5)8-10-1-2-14-8/h1-2,5H,3-4H2,(H2,9,13).
What are the key properties of 1-(1,3-oxazol-2-yl)-5-oxopyrrolidine-3-carboxamide?
1-(1,3-oxazol-2-yl)-5-oxopyrrolidine-3-carboxamide has a molecular weight of 195.18 g/mol, XLogP of -0.49, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,3-oxazol-2-yl)-5-oxopyrrolidine-3-carboxamide is sourced from PubChem (CID 168698612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).