5-(furan-2-yl)-N-(6-oxopiperidin-3-yl)-1,2-oxazole-3-carboxamide

C13H13N3O4 — CID 62491594

IUPAC5-(furan-2-yl)-N-(6-oxopiperidin-3-yl)-1,2-oxazole-3-carboxamide
SMILESO=C1CCC(NC(=O)c2cc(-c3ccco3)on2)CN1
InChIInChI=1S/C13H13N3O4/c17-12-4-3-8(7-14-12)15-13(18)9-6-11(20-16-9)10-2-1-5-19-10/h1-2,5-6,8H,3-4,7H2,(H,14,17)(H,15,18)
InChIKeyQKFVDFWNFRRAJE-UHFFFAOYSA-N
MW275.26 g/mol
LogP0.94
Rot. Bonds3

About 5-(furan-2-yl)-N-(6-oxopiperidin-3-yl)-1,2-oxazole-3-carboxamide

5-(furan-2-yl)-N-(6-oxopiperidin-3-yl)-1,2-oxazole-3-carboxamide (PubChem CID 62491594) has the molecular formula C13H13N3O4 and a molecular weight of 275.26 g/mol. Its IUPAC name is 5-(furan-2-yl)-N-(6-oxopiperidin-3-yl)-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound Name5-(furan-2-yl)-N-(6-oxopiperidin-3-yl)-1,2-oxazole-3-carboxamide
PubChem CID62491594
Molecular FormulaC13H13N3O4
Molecular Weight275.26 g/mol
Exact Mass275.09
IUPAC Name5-(furan-2-yl)-N-(6-oxopiperidin-3-yl)-1,2-oxazole-3-carboxamide
SMILESO=C1CCC(NC(=O)c2cc(-c3ccco3)on2)CN1
InChIInChI=1S/C13H13N3O4/c17-12-4-3-8(7-14-12)15-13(18)9-6-11(20-16-9)10-2-1-5-19-10/h1-2,5-6,8H,3-4,7H2,(H,14,17)(H,15,18)
InChIKeyQKFVDFWNFRRAJE-UHFFFAOYSA-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

N-(8-azabicyclo[3.2.1]octan-3-yl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide;hydrochloride
CID 119459139
5-(furan-2-yl)-N-[(3R)-2-oxopiperidin-3-yl]-1,2-oxazole-3-carboxamide
CID 94363969
5-(furan-2-yl)-N-(2-methylpiperidin-4-yl)-1,2-oxazole-3-carboxamide
CID 120601208
N-(4-ethylcyclohexyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide
CID 112817167
1-(3-chlorophenyl)-5-(furan-2-yl)-N-(6-oxopiperidin-3-yl)pyrazole-3-carboxamide
CID 60616941
5-(methoxymethyl)-N-(6-oxopiperidin-3-yl)-1,2-oxazole-3-carboxamide
CID 66157177
N-(6-oxopiperidin-3-yl)pyridine-2-carboxamide
CID 62492174
N-(6-oxopiperidin-3-yl)-1,2-oxazole-5-carboxamide
CID 63663681
3-methyl-N-(6-oxopiperidin-3-yl)-1,2-oxazole-5-carboxamide
CID 62898872
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-[2-oxo-2-[(6-oxopiperidin-3-yl)amino]ethyl]furan-2-carboxamide
CID 55211401
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

Frequently Asked Questions

What is the IUPAC name of 5-(furan-2-yl)-N-(6-oxopiperidin-3-yl)-1,2-oxazole-3-carboxamide?
The IUPAC name of 5-(furan-2-yl)-N-(6-oxopiperidin-3-yl)-1,2-oxazole-3-carboxamide (CID 62491594) is 5-(furan-2-yl)-N-(6-oxopiperidin-3-yl)-1,2-oxazole-3-carboxamide.
What is the SMILES notation for 5-(furan-2-yl)-N-(6-oxopiperidin-3-yl)-1,2-oxazole-3-carboxamide?
The canonical SMILES for 5-(furan-2-yl)-N-(6-oxopiperidin-3-yl)-1,2-oxazole-3-carboxamide is O=C1CCC(NC(=O)c2cc(-c3ccco3)on2)CN1.
What is the InChIKey of 5-(furan-2-yl)-N-(6-oxopiperidin-3-yl)-1,2-oxazole-3-carboxamide?
The InChIKey is QKFVDFWNFRRAJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N3O4/c17-12-4-3-8(7-14-12)15-13(18)9-6-11(20-16-9)10-2-1-5-19-10/h1-2,5-6,8H,3-4,7H2,(H,14,17)(H,15,18).
What are the key properties of 5-(furan-2-yl)-N-(6-oxopiperidin-3-yl)-1,2-oxazole-3-carboxamide?
5-(furan-2-yl)-N-(6-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-(6-oxopiperidin-3-yl)-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 62491594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).