5-(furan-2-yl)-N-(3-morpholin-4-ylphenyl)-1,2-oxazole-3-carboxamide

C18H17N3O4 — CID 110618704

IUPAC5-(furan-2-yl)-N-(3-morpholin-4-ylphenyl)-1,2-oxazole-3-carboxamide
SMILESO=C(Nc1cccc(N2CCOCC2)c1)c1cc(-c2ccco2)on1
InChIInChI=1S/C18H17N3O4/c22-18(15-12-17(25-20-15)16-5-2-8-24-16)19-13-3-1-4-14(11-13)21-6-9-23-10-7-21/h1-5,8,11-12H,6-7,9-10H2,(H,19,22)
InChIKeyKVDAWNHGEOELDB-UHFFFAOYSA-N
MW339.35 g/mol
LogP3.02
Rot. Bonds4

About 5-(furan-2-yl)-N-(3-morpholin-4-ylphenyl)-1,2-oxazole-3-carboxamide

5-(furan-2-yl)-N-(3-morpholin-4-ylphenyl)-1,2-oxazole-3-carboxamide (PubChem CID 110618704) has the molecular formula C18H17N3O4 and a molecular weight of 339.35 g/mol. Its IUPAC name is 5-(furan-2-yl)-N-(3-morpholin-4-ylphenyl)-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound Name5-(furan-2-yl)-N-(3-morpholin-4-ylphenyl)-1,2-oxazole-3-carboxamide
PubChem CID110618704
Molecular FormulaC18H17N3O4
Molecular Weight339.35 g/mol
Exact Mass339.12
IUPAC Name5-(furan-2-yl)-N-(3-morpholin-4-ylphenyl)-1,2-oxazole-3-carboxamide
SMILESO=C(Nc1cccc(N2CCOCC2)c1)c1cc(-c2ccco2)on1
InChIInChI=1S/C18H17N3O4/c22-18(15-12-17(25-20-15)16-5-2-8-24-16)19-13-3-1-4-14(11-13)21-6-9-23-10-7-21/h1-5,8,11-12H,6-7,9-10H2,(H,19,22)
InChIKeyKVDAWNHGEOELDB-UHFFFAOYSA-N
XLogP3.02
TPSA80.74 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.35
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-(furan-2-yl)-N-(3-morpholin-4-ylphenyl)-1,2-oxazole-3-carboxamide?
The IUPAC name of 5-(furan-2-yl)-N-(3-morpholin-4-ylphenyl)-1,2-oxazole-3-carboxamide (CID 110618704) is 5-(furan-2-yl)-N-(3-morpholin-4-ylphenyl)-1,2-oxazole-3-carboxamide.
What is the SMILES notation for 5-(furan-2-yl)-N-(3-morpholin-4-ylphenyl)-1,2-oxazole-3-carboxamide?
The canonical SMILES for 5-(furan-2-yl)-N-(3-morpholin-4-ylphenyl)-1,2-oxazole-3-carboxamide is O=C(Nc1cccc(N2CCOCC2)c1)c1cc(-c2ccco2)on1.
What is the InChIKey of 5-(furan-2-yl)-N-(3-morpholin-4-ylphenyl)-1,2-oxazole-3-carboxamide?
The InChIKey is KVDAWNHGEOELDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O4/c22-18(15-12-17(25-20-15)16-5-2-8-24-16)19-13-3-1-4-14(11-13)21-6-9-23-10-7-21/h1-5,8,11-12H,6-7,9-10H2,(H,19,22).
What are the key properties of 5-(furan-2-yl)-N-(3-morpholin-4-ylphenyl)-1,2-oxazole-3-carboxamide?
5-(furan-2-yl)-N-(3-morpholin-4-ylphenyl)-1,2-oxazole-3-carboxamide has a molecular weight of 339.35 g/mol, XLogP of 3.02, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(furan-2-yl)-N-(3-morpholin-4-ylphenyl)-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 110618704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).