2-methyl-5-oxo-N,3-diphenyl-1,2-oxazole-4-carboxamide

C17H14N2O3 — CID 110681206

IUPAC2-methyl-5-oxo-N,3-diphenyl-1,2-oxazole-4-carboxamide
SMILESCn1oc(=O)c(C(=O)Nc2ccccc2)c1-c1ccccc1
InChIInChI=1S/C17H14N2O3/c1-19-15(12-8-4-2-5-9-12)14(17(21)22-19)16(20)18-13-10-6-3-7-11-13/h2-11H,1H3,(H,18,20)
InChIKeyUPTIYPNZJBDHOX-UHFFFAOYSA-N
MW294.31 g/mol
LogP2.90
Rot. Bonds3

About 2-methyl-5-oxo-N,3-diphenyl-1,2-oxazole-4-carboxamide

2-methyl-5-oxo-N,3-diphenyl-1,2-oxazole-4-carboxamide (PubChem CID 110681206) has the molecular formula C17H14N2O3 and a molecular weight of 294.31 g/mol. Its IUPAC name is 2-methyl-5-oxo-N,3-diphenyl-1,2-oxazole-4-carboxamide.

Molecular Properties

Compound Name2-methyl-5-oxo-N,3-diphenyl-1,2-oxazole-4-carboxamide
PubChem CID110681206
Molecular FormulaC17H14N2O3
Molecular Weight294.31 g/mol
Exact Mass294.10
IUPAC Name2-methyl-5-oxo-N,3-diphenyl-1,2-oxazole-4-carboxamide
SMILESCn1oc(=O)c(C(=O)Nc2ccccc2)c1-c1ccccc1
InChIInChI=1S/C17H14N2O3/c1-19-15(12-8-4-2-5-9-12)14(17(21)22-19)16(20)18-13-10-6-3-7-11-13/h2-11H,1H3,(H,18,20)
InChIKeyUPTIYPNZJBDHOX-UHFFFAOYSA-N
XLogP2.90
TPSA64.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.31
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-N-(3-methylphenyl)-5-oxo-3-phenyl-1,2-oxazole-4-carboxamide
CID 110681208
N-(2,6-dimethylphenyl)-2-methyl-5-oxo-3-phenyl-1,2-oxazole-4-carboxamide
CID 110681217
N-(2-fluorophenyl)-2-methyl-5-oxo-3-phenyl-1,2-oxazole-4-carboxamide
CID 110681224
N-(1,3-benzodioxol-5-yl)-2-methyl-5-oxo-3-phenyl-1,2-oxazole-4-carboxamide
CID 110681249
N-benzyl-2-methyl-5-oxo-3-phenyl-1,2-oxazole-4-carboxamide
CID 110681169
2-methyl-N-(2-methylpropyl)-5-oxo-3-phenyl-1,2-oxazole-4-carboxamide
CID 110681149
2,4-dimethyl-3-phenyl-1,2-oxazol-5-one
CID 604974
N-(4-cyanophenyl)-2,3-dimethyl-5-oxo-1,2-oxazole-4-carboxamide
CID 110681138
2,3,4,5,6-pentamethyl-N-phenylbenzamide
CID 60629319
N-(3-fluorophenyl)-2-methyl-5-oxo-4-phenyl-1,2-oxazole-3-carboxamide
CID 110680910
N-(3-chlorophenyl)-2-methyl-5-oxo-4-phenyl-1,2-oxazole-3-carboxamide
CID 110680893
4-hydroxy-5-methyl-2-oxo-N-phenylpyrano[3,2-b]indole-3-carboxamide
CID 54696259

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-oxo-N,3-diphenyl-1,2-oxazole-4-carboxamide?
The IUPAC name of 2-methyl-5-oxo-N,3-diphenyl-1,2-oxazole-4-carboxamide (CID 110681206) is 2-methyl-5-oxo-N,3-diphenyl-1,2-oxazole-4-carboxamide.
What is the SMILES notation for 2-methyl-5-oxo-N,3-diphenyl-1,2-oxazole-4-carboxamide?
The canonical SMILES for 2-methyl-5-oxo-N,3-diphenyl-1,2-oxazole-4-carboxamide is Cn1oc(=O)c(C(=O)Nc2ccccc2)c1-c1ccccc1.
What is the InChIKey of 2-methyl-5-oxo-N,3-diphenyl-1,2-oxazole-4-carboxamide?
The InChIKey is UPTIYPNZJBDHOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N2O3/c1-19-15(12-8-4-2-5-9-12)14(17(21)22-19)16(20)18-13-10-6-3-7-11-13/h2-11H,1H3,(H,18,20).
What are the key properties of 2-methyl-5-oxo-N,3-diphenyl-1,2-oxazole-4-carboxamide?
2-methyl-5-oxo-N,3-diphenyl-1,2-oxazole-4-carboxamide has a molecular weight of 294.31 g/mol, XLogP of 2.90, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-oxo-N,3-diphenyl-1,2-oxazole-4-carboxamide is sourced from PubChem (CID 110681206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).