3-methyl-N-(3-phenoxyphenyl)-1,2-oxazole-5-carboxamide

C17H14N2O3 — CID 51204920

IUPAC3-methyl-N-(3-phenoxyphenyl)-1,2-oxazole-5-carboxamide
SMILESCc1cc(C(=O)Nc2cccc(Oc3ccccc3)c2)on1
InChIInChI=1S/C17H14N2O3/c1-12-10-16(22-19-12)17(20)18-13-6-5-9-15(11-13)21-14-7-3-2-4-8-14/h2-11H,1H3,(H,18,20)
InChIKeyVHPKRCJAWYKBAS-UHFFFAOYSA-N
MW294.31 g/mol
LogP4.03
Rot. Bonds4

About 3-methyl-N-(3-phenoxyphenyl)-1,2-oxazole-5-carboxamide

3-methyl-N-(3-phenoxyphenyl)-1,2-oxazole-5-carboxamide (PubChem CID 51204920) has the molecular formula C17H14N2O3 and a molecular weight of 294.31 g/mol. Its IUPAC name is 3-methyl-N-(3-phenoxyphenyl)-1,2-oxazole-5-carboxamide.

Molecular Properties

Compound Name3-methyl-N-(3-phenoxyphenyl)-1,2-oxazole-5-carboxamide
PubChem CID51204920
Molecular FormulaC17H14N2O3
Molecular Weight294.31 g/mol
Exact Mass294.10
IUPAC Name3-methyl-N-(3-phenoxyphenyl)-1,2-oxazole-5-carboxamide
SMILESCc1cc(C(=O)Nc2cccc(Oc3ccccc3)c2)on1
InChIInChI=1S/C17H14N2O3/c1-12-10-16(22-19-12)17(20)18-13-6-5-9-15(11-13)21-14-7-3-2-4-8-14/h2-11H,1H3,(H,18,20)
InChIKeyVHPKRCJAWYKBAS-UHFFFAOYSA-N
XLogP4.03
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 ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-benzamidophenyl)-3-methyl-1,2-oxazole-5-carboxamide
CID 43911458
3-methyl-N-[3-[(2-phenylacetyl)amino]phenyl]-1,2-oxazole-5-carboxamide
CID 43911461
N-(3-fluorophenyl)-3-methyl-1,2-oxazole-5-carboxamide
CID 16606648
3-methyl-N-[4-(2-phenoxyethoxy)phenyl]-1,2-oxazole-5-carboxamide
CID 43911371
N-(4-benzamidophenyl)-3-methyl-1,2-oxazole-5-carboxamide
CID 43911460
3-methyl-N-[3-(pyridine-4-carbonylamino)phenyl]-1,2-oxazole-5-carboxamide
CID 39186715
N-[3-(aminomethyl)phenyl]-3-methyl-1,2-oxazole-5-carboxamide
CID 63254601
3-methyl-N-(2-phenylpyrimidin-5-yl)-1,2-oxazole-5-carboxamide
CID 134009492
N-[3-[(4-tert-butylbenzoyl)amino]phenyl]-3-methyl-1,2-oxazole-5-carboxamide
CID 43911455
4-methyl-N-(3-phenoxyphenyl)benzamide
CID 59304535
N-[3-(N'-hydroxycarbamimidoyl)phenyl]-3-methyl-1,2-oxazole-5-carboxamide
CID 76930098
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(3-phenoxyphenyl)acetamide
CID 78794827

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(3-phenoxyphenyl)-1,2-oxazole-5-carboxamide?
The IUPAC name of 3-methyl-N-(3-phenoxyphenyl)-1,2-oxazole-5-carboxamide (CID 51204920) is 3-methyl-N-(3-phenoxyphenyl)-1,2-oxazole-5-carboxamide.
What is the SMILES notation for 3-methyl-N-(3-phenoxyphenyl)-1,2-oxazole-5-carboxamide?
The canonical SMILES for 3-methyl-N-(3-phenoxyphenyl)-1,2-oxazole-5-carboxamide is Cc1cc(C(=O)Nc2cccc(Oc3ccccc3)c2)on1.
What is the InChIKey of 3-methyl-N-(3-phenoxyphenyl)-1,2-oxazole-5-carboxamide?
The InChIKey is VHPKRCJAWYKBAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N2O3/c1-12-10-16(22-19-12)17(20)18-13-6-5-9-15(11-13)21-14-7-3-2-4-8-14/h2-11H,1H3,(H,18,20).
What are the key properties of 3-methyl-N-(3-phenoxyphenyl)-1,2-oxazole-5-carboxamide?
3-methyl-N-(3-phenoxyphenyl)-1,2-oxazole-5-carboxamide has a molecular weight of 294.31 g/mol, XLogP of 4.03, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(3-phenoxyphenyl)-1,2-oxazole-5-carboxamide is sourced from PubChem (CID 51204920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).