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

C14H16N2O3 — CID 38999572

IUPAC5-methyl-N-(2-propan-2-yloxyphenyl)-1,2-oxazole-3-carboxamide
SMILESCc1cc(C(=O)Nc2ccccc2OC(C)C)no1
InChIInChI=1S/C14H16N2O3/c1-9(2)18-13-7-5-4-6-11(13)15-14(17)12-8-10(3)19-16-12/h4-9H,1-3H3,(H,15,17)
InChIKeyZSSWWWLPQKEUPJ-UHFFFAOYSA-N
MW260.29 g/mol
LogP3.02
Rot. Bonds4

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

5-methyl-N-(2-propan-2-yloxyphenyl)-1,2-oxazole-3-carboxamide (PubChem CID 38999572) has the molecular formula C14H16N2O3 and a molecular weight of 260.29 g/mol. Its IUPAC name is 5-methyl-N-(2-propan-2-yloxyphenyl)-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound Name5-methyl-N-(2-propan-2-yloxyphenyl)-1,2-oxazole-3-carboxamide
PubChem CID38999572
Molecular FormulaC14H16N2O3
Molecular Weight260.29 g/mol
Exact Mass260.12
IUPAC Name5-methyl-N-(2-propan-2-yloxyphenyl)-1,2-oxazole-3-carboxamide
SMILESCc1cc(C(=O)Nc2ccccc2OC(C)C)no1
InChIInChI=1S/C14H16N2O3/c1-9(2)18-13-7-5-4-6-11(13)15-14(17)12-8-10(3)19-16-12/h4-9H,1-3H3,(H,15,17)
InChIKeyZSSWWWLPQKEUPJ-UHFFFAOYSA-N
XLogP3.02
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.29
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-[(5-methyl-1,2-oxazol-3-yl)amino]-N-(2-propan-2-yloxyphenyl)pyridazine-3-carboxamide
CID 109129623
N-(2-propan-2-yloxyphenyl)-1,2-oxazole-3-carboxamide
CID 110693809
4-methyl-N-(2-propan-2-yloxyphenyl)-1,2-oxazole-3-carboxamide
CID 110860342
2,5-dimethyl-N-(2-propan-2-yloxyphenyl)furan-3-carboxamide
CID 39000210
6-N-propan-2-yl-2-N-(2-propan-2-yloxyphenyl)pyridine-2,6-dicarboxamide
CID 109093744
N-[2-(2-amino-2-hydroxyiminoethoxy)phenyl]-5-methyl-1,2-oxazole-3-carboxamide
CID 77113421
3,5-dichloro-N-(2-propan-2-yloxyphenyl)benzamide
CID 17151016
5-chloro-N-(2-propan-2-yloxyphenyl)pyrazine-2-carboxamide
CID 103817156
N-(2-propan-2-yloxyphenyl)-2H-triazole-4-carboxamide
CID 47370046
2-chloro-N-(2-propan-2-yloxyphenyl)furan-3-carboxamide
CID 106685838
N,N'-bis(2-propan-2-yloxyphenyl)oxamide
CID 108987298
3-methyl-N-(2-propan-2-yloxyphenyl)benzamide
CID 17150877

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(2-propan-2-yloxyphenyl)-1,2-oxazole-3-carboxamide?
The IUPAC name of 5-methyl-N-(2-propan-2-yloxyphenyl)-1,2-oxazole-3-carboxamide (CID 38999572) is 5-methyl-N-(2-propan-2-yloxyphenyl)-1,2-oxazole-3-carboxamide.
What is the SMILES notation for 5-methyl-N-(2-propan-2-yloxyphenyl)-1,2-oxazole-3-carboxamide?
The canonical SMILES for 5-methyl-N-(2-propan-2-yloxyphenyl)-1,2-oxazole-3-carboxamide is Cc1cc(C(=O)Nc2ccccc2OC(C)C)no1.
What is the InChIKey of 5-methyl-N-(2-propan-2-yloxyphenyl)-1,2-oxazole-3-carboxamide?
The InChIKey is ZSSWWWLPQKEUPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O3/c1-9(2)18-13-7-5-4-6-11(13)15-14(17)12-8-10(3)19-16-12/h4-9H,1-3H3,(H,15,17).
What are the key properties of 5-methyl-N-(2-propan-2-yloxyphenyl)-1,2-oxazole-3-carboxamide?
5-methyl-N-(2-propan-2-yloxyphenyl)-1,2-oxazole-3-carboxamide has a molecular weight of 260.29 g/mol, XLogP of 3.02, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(2-propan-2-yloxyphenyl)-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 38999572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).