5-(4-methoxyphenyl)-N-[(5-methylfuran-2-yl)methyl]-1,2-oxazole-3-carboxamide

C17H16N2O4 — CID 46087342

IUPAC5-(4-methoxyphenyl)-N-[(5-methylfuran-2-yl)methyl]-1,2-oxazole-3-carboxamide
SMILESCOc1ccc(-c2cc(C(=O)NCc3ccc(C)o3)no2)cc1
InChIInChI=1S/C17H16N2O4/c1-11-3-6-14(22-11)10-18-17(20)15-9-16(23-19-15)12-4-7-13(21-2)8-5-12/h3-9H,10H2,1-2H3,(H,18,20)
InChIKeyVIGKTBQKGYHAAN-UHFFFAOYSA-N
MW312.33 g/mol
LogP3.18
Rot. Bonds5

About 5-(4-methoxyphenyl)-N-[(5-methylfuran-2-yl)methyl]-1,2-oxazole-3-carboxamide

5-(4-methoxyphenyl)-N-[(5-methylfuran-2-yl)methyl]-1,2-oxazole-3-carboxamide (PubChem CID 46087342) has the molecular formula C17H16N2O4 and a molecular weight of 312.33 g/mol. Its IUPAC name is 5-(4-methoxyphenyl)-N-[(5-methylfuran-2-yl)methyl]-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound Name5-(4-methoxyphenyl)-N-[(5-methylfuran-2-yl)methyl]-1,2-oxazole-3-carboxamide
PubChem CID46087342
Molecular FormulaC17H16N2O4
Molecular Weight312.33 g/mol
Exact Mass312.11
IUPAC Name5-(4-methoxyphenyl)-N-[(5-methylfuran-2-yl)methyl]-1,2-oxazole-3-carboxamide
SMILESCOc1ccc(-c2cc(C(=O)NCc3ccc(C)o3)no2)cc1
InChIInChI=1S/C17H16N2O4/c1-11-3-6-14(22-11)10-18-17(20)15-9-16(23-19-15)12-4-7-13(21-2)8-5-12/h3-9H,10H2,1-2H3,(H,18,20)
InChIKeyVIGKTBQKGYHAAN-UHFFFAOYSA-N
XLogP3.18
TPSA77.50 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.33
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-(4-methoxyphenyl)-N-[(5-methylfuran-2-yl)methyl]-1,2-oxazole-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-(4-methoxyphenyl)-N-[(5-methylfuran-2-yl)methyl]-1,2-oxazole-3-carboxamide?
The IUPAC name of 5-(4-methoxyphenyl)-N-[(5-methylfuran-2-yl)methyl]-1,2-oxazole-3-carboxamide (CID 46087342) is 5-(4-methoxyphenyl)-N-[(5-methylfuran-2-yl)methyl]-1,2-oxazole-3-carboxamide.
What is the SMILES notation for 5-(4-methoxyphenyl)-N-[(5-methylfuran-2-yl)methyl]-1,2-oxazole-3-carboxamide?
The canonical SMILES for 5-(4-methoxyphenyl)-N-[(5-methylfuran-2-yl)methyl]-1,2-oxazole-3-carboxamide is COc1ccc(-c2cc(C(=O)NCc3ccc(C)o3)no2)cc1.
What is the InChIKey of 5-(4-methoxyphenyl)-N-[(5-methylfuran-2-yl)methyl]-1,2-oxazole-3-carboxamide?
The InChIKey is VIGKTBQKGYHAAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O4/c1-11-3-6-14(22-11)10-18-17(20)15-9-16(23-19-15)12-4-7-13(21-2)8-5-12/h3-9H,10H2,1-2H3,(H,18,20).
What are the key properties of 5-(4-methoxyphenyl)-N-[(5-methylfuran-2-yl)methyl]-1,2-oxazole-3-carboxamide?
5-(4-methoxyphenyl)-N-[(5-methylfuran-2-yl)methyl]-1,2-oxazole-3-carboxamide has a molecular weight of 312.33 g/mol, XLogP of 3.18, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-methoxyphenyl)-N-[(5-methylfuran-2-yl)methyl]-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 46087342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).