5-(furan-2-yl)-N-(1-hydroxy-4-methylpentan-2-yl)-1,2-oxazole-3-carboxamide

C14H18N2O4 — CID 61245918

IUPAC5-(furan-2-yl)-N-(1-hydroxy-4-methylpentan-2-yl)-1,2-oxazole-3-carboxamide
SMILESCC(C)CC(CO)NC(=O)c1cc(-c2ccco2)on1
InChIInChI=1S/C14H18N2O4/c1-9(2)6-10(8-17)15-14(18)11-7-13(20-16-11)12-4-3-5-19-12/h3-5,7,9-10,17H,6,8H2,1-2H3,(H,15,18)
InChIKeyQDMKWDQWLNTFFK-UHFFFAOYSA-N
MW278.31 g/mol
LogP2.07
Rot. Bonds6

About 5-(furan-2-yl)-N-(1-hydroxy-4-methylpentan-2-yl)-1,2-oxazole-3-carboxamide

5-(furan-2-yl)-N-(1-hydroxy-4-methylpentan-2-yl)-1,2-oxazole-3-carboxamide (PubChem CID 61245918) has the molecular formula C14H18N2O4 and a molecular weight of 278.31 g/mol. Its IUPAC name is 5-(furan-2-yl)-N-(1-hydroxy-4-methylpentan-2-yl)-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound Name5-(furan-2-yl)-N-(1-hydroxy-4-methylpentan-2-yl)-1,2-oxazole-3-carboxamide
PubChem CID61245918
Molecular FormulaC14H18N2O4
Molecular Weight278.31 g/mol
Exact Mass278.13
IUPAC Name5-(furan-2-yl)-N-(1-hydroxy-4-methylpentan-2-yl)-1,2-oxazole-3-carboxamide
SMILESCC(C)CC(CO)NC(=O)c1cc(-c2ccco2)on1
InChIInChI=1S/C14H18N2O4/c1-9(2)6-10(8-17)15-14(18)11-7-13(20-16-11)12-4-3-5-19-12/h3-5,7,9-10,17H,6,8H2,1-2H3,(H,15,18)
InChIKeyQDMKWDQWLNTFFK-UHFFFAOYSA-N
XLogP2.07
TPSA88.50 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.31
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-(furan-2-yl)-N-(1-hydroxy-4-methylpentan-2-yl)-1,2-oxazole-3-carboxamide?
The IUPAC name of 5-(furan-2-yl)-N-(1-hydroxy-4-methylpentan-2-yl)-1,2-oxazole-3-carboxamide (CID 61245918) is 5-(furan-2-yl)-N-(1-hydroxy-4-methylpentan-2-yl)-1,2-oxazole-3-carboxamide.
What is the SMILES notation for 5-(furan-2-yl)-N-(1-hydroxy-4-methylpentan-2-yl)-1,2-oxazole-3-carboxamide?
The canonical SMILES for 5-(furan-2-yl)-N-(1-hydroxy-4-methylpentan-2-yl)-1,2-oxazole-3-carboxamide is CC(C)CC(CO)NC(=O)c1cc(-c2ccco2)on1.
What is the InChIKey of 5-(furan-2-yl)-N-(1-hydroxy-4-methylpentan-2-yl)-1,2-oxazole-3-carboxamide?
The InChIKey is QDMKWDQWLNTFFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O4/c1-9(2)6-10(8-17)15-14(18)11-7-13(20-16-11)12-4-3-5-19-12/h3-5,7,9-10,17H,6,8H2,1-2H3,(H,15,18).
What are the key properties of 5-(furan-2-yl)-N-(1-hydroxy-4-methylpentan-2-yl)-1,2-oxazole-3-carboxamide?
5-(furan-2-yl)-N-(1-hydroxy-4-methylpentan-2-yl)-1,2-oxazole-3-carboxamide has a molecular weight of 278.31 g/mol, XLogP of 2.07, 6 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-(1-hydroxy-4-methylpentan-2-yl)-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 61245918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).