5-(furan-2-yl)-N-[(3R)-2-oxopiperidin-3-yl]-1,2-oxazole-3-carboxamide

C13H13N3O4 — CID 94363969

IUPAC5-(furan-2-yl)-N-[(3R)-2-oxopiperidin-3-yl]-1,2-oxazole-3-carboxamide
SMILESO=C(N[C@@H]1CCCNC1=O)c1cc(-c2ccco2)on1
InChIInChI=1S/C13H13N3O4/c17-12-8(3-1-5-14-12)15-13(18)9-7-11(20-16-9)10-4-2-6-19-10/h2,4,6-8H,1,3,5H2,(H,14,17)(H,15,18)/t8-/m1/s1
InChIKeyUHBPWTGYNKIUJU-MRVPVSSYSA-N
MW275.26 g/mol
LogP0.94
Rot. Bonds3

About 5-(furan-2-yl)-N-[(3R)-2-oxopiperidin-3-yl]-1,2-oxazole-3-carboxamide

5-(furan-2-yl)-N-[(3R)-2-oxopiperidin-3-yl]-1,2-oxazole-3-carboxamide (PubChem CID 94363969) has the molecular formula C13H13N3O4 and a molecular weight of 275.26 g/mol. Its IUPAC name is 5-(furan-2-yl)-N-[(3R)-2-oxopiperidin-3-yl]-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound Name5-(furan-2-yl)-N-[(3R)-2-oxopiperidin-3-yl]-1,2-oxazole-3-carboxamide
PubChem CID94363969
Molecular FormulaC13H13N3O4
Molecular Weight275.26 g/mol
Exact Mass275.09
IUPAC Name5-(furan-2-yl)-N-[(3R)-2-oxopiperidin-3-yl]-1,2-oxazole-3-carboxamide
SMILESO=C(N[C@@H]1CCCNC1=O)c1cc(-c2ccco2)on1
InChIInChI=1S/C13H13N3O4/c17-12-8(3-1-5-14-12)15-13(18)9-7-11(20-16-9)10-4-2-6-19-10/h2,4,6-8H,1,3,5H2,(H,14,17)(H,15,18)/t8-/m1/s1
InChIKeyUHBPWTGYNKIUJU-MRVPVSSYSA-N
XLogP0.94
TPSA97.37 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.26
LogP ≤ 50.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-(furan-2-yl)-N-(6-oxopiperidin-3-yl)-1,2-oxazole-3-carboxamide
CID 62491594
5-(furan-2-yl)-N-(2-methylpiperidin-4-yl)-1,2-oxazole-3-carboxamide
CID 120601208
N-(8-azabicyclo[3.2.1]octan-3-yl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;hydrochloride
CID 119459139
N-(4-ethylcyclohexyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide
CID 112817167
N-[(1R,8aS)-1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide
CID 100839328
1-(2,4-dimethylphenyl)-3-(furan-2-yl)-N-[(3R)-2-oxoazepan-3-yl]pyrazole-5-carboxamide
CID 1053817
1-N-[(3S)-2-oxopiperidin-3-yl]-2-N-[(3R)-2-oxopiperidin-3-yl]benzene-1,2-dicarboxamide
CID 26791100
8-chloro-2-(furan-2-yl)-N-(2-oxoazepan-3-yl)quinoline-4-carboxamide
CID 156607428
(3R)-4-[5-(furan-2-yl)-1,2-oxazole-3-carbonyl]-3-methylpiperazin-2-one
CID 95703001
N-[(1R,2R)-2-(2,4-dioxo-1,3-thiazolidin-3-yl)cyclohexyl]-5-(furan-2-yl)-1,2-oxazole-3-carboxamide
CID 51896540
N-(1-benzyl-4,5,6,7-tetrahydroindazol-4-yl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide
CID 110236802
6-amino-N-(2-oxopiperidin-3-yl)pyridazine-3-carboxamide
CID 55041508

Frequently Asked Questions

What is the IUPAC name of 5-(furan-2-yl)-N-[(3R)-2-oxopiperidin-3-yl]-1,2-oxazole-3-carboxamide?
The IUPAC name of 5-(furan-2-yl)-N-[(3R)-2-oxopiperidin-3-yl]-1,2-oxazole-3-carboxamide (CID 94363969) is 5-(furan-2-yl)-N-[(3R)-2-oxopiperidin-3-yl]-1,2-oxazole-3-carboxamide.
What is the SMILES notation for 5-(furan-2-yl)-N-[(3R)-2-oxopiperidin-3-yl]-1,2-oxazole-3-carboxamide?
The canonical SMILES for 5-(furan-2-yl)-N-[(3R)-2-oxopiperidin-3-yl]-1,2-oxazole-3-carboxamide is O=C(N[C@@H]1CCCNC1=O)c1cc(-c2ccco2)on1.
What is the InChIKey of 5-(furan-2-yl)-N-[(3R)-2-oxopiperidin-3-yl]-1,2-oxazole-3-carboxamide?
The InChIKey is UHBPWTGYNKIUJU-MRVPVSSYSA-N. The full InChI is InChI=1S/C13H13N3O4/c17-12-8(3-1-5-14-12)15-13(18)9-7-11(20-16-9)10-4-2-6-19-10/h2,4,6-8H,1,3,5H2,(H,14,17)(H,15,18)/t8-/m1/s1.
What are the key properties of 5-(furan-2-yl)-N-[(3R)-2-oxopiperidin-3-yl]-1,2-oxazole-3-carboxamide?
5-(furan-2-yl)-N-[(3R)-2-oxopiperidin-3-yl]-1,2-oxazole-3-carboxamide has a molecular weight of 275.26 g/mol, XLogP of 0.94, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(furan-2-yl)-N-[(3R)-2-oxopiperidin-3-yl]-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 94363969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).