N-(3-acetylphenyl)-2-(furan-2-carbonylamino)-1,3-oxazole-4-carboxamide

C17H13N3O5 — CID 52907935

IUPACN-(3-acetylphenyl)-2-(furan-2-carbonylamino)-1,3-oxazole-4-carboxamide
SMILESCC(=O)c1cccc(NC(=O)c2coc(NC(=O)c3ccco3)n2)c1
InChIInChI=1S/C17H13N3O5/c1-10(21)11-4-2-5-12(8-11)18-15(22)13-9-25-17(19-13)20-16(23)14-6-3-7-24-14/h2-9H,1H3,(H,18,22)(H,19,20,23)
InChIKeyUHZRFTQSDHIKPF-UHFFFAOYSA-N
MW339.31 g/mol
LogP2.97
Rot. Bonds5

About N-(3-acetylphenyl)-2-(furan-2-carbonylamino)-1,3-oxazole-4-carboxamide

N-(3-acetylphenyl)-2-(furan-2-carbonylamino)-1,3-oxazole-4-carboxamide (PubChem CID 52907935) has the molecular formula C17H13N3O5 and a molecular weight of 339.31 g/mol. Its IUPAC name is N-(3-acetylphenyl)-2-(furan-2-carbonylamino)-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound NameN-(3-acetylphenyl)-2-(furan-2-carbonylamino)-1,3-oxazole-4-carboxamide
PubChem CID52907935
Molecular FormulaC17H13N3O5
Molecular Weight339.31 g/mol
Exact Mass339.09
IUPAC NameN-(3-acetylphenyl)-2-(furan-2-carbonylamino)-1,3-oxazole-4-carboxamide
SMILESCC(=O)c1cccc(NC(=O)c2coc(NC(=O)c3ccco3)n2)c1
InChIInChI=1S/C17H13N3O5/c1-10(21)11-4-2-5-12(8-11)18-15(22)13-9-25-17(19-13)20-16(23)14-6-3-7-24-14/h2-9H,1H3,(H,18,22)(H,19,20,23)
InChIKeyUHZRFTQSDHIKPF-UHFFFAOYSA-N
XLogP2.97
TPSA114.44 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.31
LogP ≤ 52.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(3-chloro-4-fluorophenyl)-2-(furan-2-carbonylamino)-1,3-oxazole-4-carboxamide
CID 90515189
N-[4-(3-acetylanilino)phenyl]furan-2-carboxamide
CID 112988117
N-[4-(dimethylamino)phenyl]-2-(furan-2-carbonylamino)-1,3-oxazole-4-carboxamide
CID 90515175
N-[3-[(3-acetamidophenyl)carbamoyl]phenyl]furan-2-carboxamide
CID 27244358
2-(furan-2-carbonylamino)-N-propan-2-yl-1,3-oxazole-4-carboxamide
CID 90515122
N-[3-[(4-acetamidophenyl)carbamoyl]phenyl]furan-2-carboxamide
CID 51179863
2-benzamido-N-(3-bromophenyl)-1,3-oxazole-4-carboxamide
CID 90514961
2-(furan-2-carbonylamino)-N-(4-sulfamoylphenyl)-1,3-oxazole-4-carboxamide
CID 90515186
6-N-(3-acetylphenyl)-2-N-(furan-2-ylmethyl)pyridine-2,6-dicarboxamide
CID 109097178
2-(furan-2-carbonylamino)-N-[2-(3-methoxyphenyl)ethyl]-1,3-oxazole-4-carboxamide
CID 90515219
N-[3-(N-benzamido-C-methylcarbonimidoyl)phenyl]furan-2-carboxamide
CID 4548216
N-[2-(4-chlorophenyl)ethyl]-2-(furan-2-carbonylamino)-1,3-oxazole-4-carboxamide
CID 90515222

Frequently Asked Questions

What is the IUPAC name of N-(3-acetylphenyl)-2-(furan-2-carbonylamino)-1,3-oxazole-4-carboxamide?
The IUPAC name of N-(3-acetylphenyl)-2-(furan-2-carbonylamino)-1,3-oxazole-4-carboxamide (CID 52907935) is N-(3-acetylphenyl)-2-(furan-2-carbonylamino)-1,3-oxazole-4-carboxamide.
What is the SMILES notation for N-(3-acetylphenyl)-2-(furan-2-carbonylamino)-1,3-oxazole-4-carboxamide?
The canonical SMILES for N-(3-acetylphenyl)-2-(furan-2-carbonylamino)-1,3-oxazole-4-carboxamide is CC(=O)c1cccc(NC(=O)c2coc(NC(=O)c3ccco3)n2)c1.
What is the InChIKey of N-(3-acetylphenyl)-2-(furan-2-carbonylamino)-1,3-oxazole-4-carboxamide?
The InChIKey is UHZRFTQSDHIKPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13N3O5/c1-10(21)11-4-2-5-12(8-11)18-15(22)13-9-25-17(19-13)20-16(23)14-6-3-7-24-14/h2-9H,1H3,(H,18,22)(H,19,20,23).
What are the key properties of N-(3-acetylphenyl)-2-(furan-2-carbonylamino)-1,3-oxazole-4-carboxamide?
N-(3-acetylphenyl)-2-(furan-2-carbonylamino)-1,3-oxazole-4-carboxamide has a molecular weight of 339.31 g/mol, XLogP of 2.97, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetylphenyl)-2-(furan-2-carbonylamino)-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 52907935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).