3-(4-methoxyphenyl)-N-phenyl-1,2-oxazole-5-carboxamide

C17H14N2O3 — CID 2769299

IUPAC3-(4-methoxyphenyl)-N-phenyl-1,2-oxazole-5-carboxamide
SMILESCOc1ccc(-c2cc(C(=O)Nc3ccccc3)on2)cc1
InChIInChI=1S/C17H14N2O3/c1-21-14-9-7-12(8-10-14)15-11-16(22-19-15)17(20)18-13-5-3-2-4-6-13/h2-11H,1H3,(H,18,20)
InChIKeyWHPVSRMCTGJXSY-UHFFFAOYSA-N
MW294.31 g/mol
LogP3.60
Rot. Bonds4

About 3-(4-methoxyphenyl)-N-phenyl-1,2-oxazole-5-carboxamide

3-(4-methoxyphenyl)-N-phenyl-1,2-oxazole-5-carboxamide (PubChem CID 2769299) has the molecular formula C17H14N2O3 and a molecular weight of 294.31 g/mol. Its IUPAC name is 3-(4-methoxyphenyl)-N-phenyl-1,2-oxazole-5-carboxamide.

Molecular Properties

Compound Name3-(4-methoxyphenyl)-N-phenyl-1,2-oxazole-5-carboxamide
PubChem CID2769299
Molecular FormulaC17H14N2O3
Molecular Weight294.31 g/mol
Exact Mass294.10
IUPAC Name3-(4-methoxyphenyl)-N-phenyl-1,2-oxazole-5-carboxamide
SMILESCOc1ccc(-c2cc(C(=O)Nc3ccccc3)on2)cc1
InChIInChI=1S/C17H14N2O3/c1-21-14-9-7-12(8-10-14)15-11-16(22-19-15)17(20)18-13-5-3-2-4-6-13/h2-11H,1H3,(H,18,20)
InChIKeyWHPVSRMCTGJXSY-UHFFFAOYSA-N
XLogP3.60
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.31
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

T56-LIMKi
CID 9438169
N-(3,4-dimethoxyphenyl)-5-phenyl-1,2-oxazole-3-carboxamide
CID 1093725
N-(4-methoxyphenyl)-5-phenyl-1,2-oxazole-3-carboxamide
CID 1093730
N-(2-acetylphenyl)-4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzamide
CID 2466270
4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-(2,3-dimethylphenyl)benzamide
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N-(4-fluorophenyl)-3-phenyl-1,2-oxazole-5-carboxamide
CID 2769315
4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-(2-methylphenyl)benzamide
CID 2534940
2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-~{N}-(3-methoxyphenyl)benzamide
CID 25163346
5-methyl-3-phenyl-N-(2-propoxyphenyl)-1,2-oxazole-4-carboxamide
CID 2197808
5-methyl-3-phenyl-N-(3-propoxyphenyl)-4-isoxazolecarboxamide
CID 2260458
N-(4-methoxyphenyl)-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide
CID 1093771
4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-phenylbenzamide
CID 2574590

Frequently Asked Questions

What is the IUPAC name of 3-(4-methoxyphenyl)-N-phenyl-1,2-oxazole-5-carboxamide?
The IUPAC name of 3-(4-methoxyphenyl)-N-phenyl-1,2-oxazole-5-carboxamide (CID 2769299) is 3-(4-methoxyphenyl)-N-phenyl-1,2-oxazole-5-carboxamide.
What is the SMILES notation for 3-(4-methoxyphenyl)-N-phenyl-1,2-oxazole-5-carboxamide?
The canonical SMILES for 3-(4-methoxyphenyl)-N-phenyl-1,2-oxazole-5-carboxamide is COc1ccc(-c2cc(C(=O)Nc3ccccc3)on2)cc1.
What is the InChIKey of 3-(4-methoxyphenyl)-N-phenyl-1,2-oxazole-5-carboxamide?
The InChIKey is WHPVSRMCTGJXSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N2O3/c1-21-14-9-7-12(8-10-14)15-11-16(22-19-15)17(20)18-13-5-3-2-4-6-13/h2-11H,1H3,(H,18,20).
What are the key properties of 3-(4-methoxyphenyl)-N-phenyl-1,2-oxazole-5-carboxamide?
3-(4-methoxyphenyl)-N-phenyl-1,2-oxazole-5-carboxamide has a molecular weight of 294.31 g/mol, XLogP of 3.60, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methoxyphenyl)-N-phenyl-1,2-oxazole-5-carboxamide is sourced from PubChem (CID 2769299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).