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

C12H12N2O2 — CID 5307543

IUPAC4-methyl-N-(2-methylphenyl)-1,3-oxazole-5-carboxamide
SMILESCc1ccccc1NC(=O)c1ocnc1C
InChIInChI=1S/C12H12N2O2/c1-8-5-3-4-6-10(8)14-12(15)11-9(2)13-7-16-11/h3-7H,1-2H3,(H,14,15)
InChIKeyRHMPONHOKPTRDI-UHFFFAOYSA-N
MW216.24 g/mol
LogP2.54
Rot. Bonds2

About 4-methyl-N-(2-methylphenyl)-1,3-oxazole-5-carboxamide

4-methyl-N-(2-methylphenyl)-1,3-oxazole-5-carboxamide (PubChem CID 5307543) has the molecular formula C12H12N2O2 and a molecular weight of 216.24 g/mol. Its IUPAC name is 4-methyl-N-(2-methylphenyl)-1,3-oxazole-5-carboxamide.

Molecular Properties

Compound Name4-methyl-N-(2-methylphenyl)-1,3-oxazole-5-carboxamide
PubChem CID5307543
Molecular FormulaC12H12N2O2
Molecular Weight216.24 g/mol
Exact Mass216.09
IUPAC Name4-methyl-N-(2-methylphenyl)-1,3-oxazole-5-carboxamide
SMILESCc1ccccc1NC(=O)c1ocnc1C
InChIInChI=1S/C12H12N2O2/c1-8-5-3-4-6-10(8)14-12(15)11-9(2)13-7-16-11/h3-7H,1-2H3,(H,14,15)
InChIKeyRHMPONHOKPTRDI-UHFFFAOYSA-N
XLogP2.54
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.24
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(2-methylphenyl)-1,3-oxazole-5-carboxamide?
The IUPAC name of 4-methyl-N-(2-methylphenyl)-1,3-oxazole-5-carboxamide (CID 5307543) is 4-methyl-N-(2-methylphenyl)-1,3-oxazole-5-carboxamide.
What is the SMILES notation for 4-methyl-N-(2-methylphenyl)-1,3-oxazole-5-carboxamide?
The canonical SMILES for 4-methyl-N-(2-methylphenyl)-1,3-oxazole-5-carboxamide is Cc1ccccc1NC(=O)c1ocnc1C.
What is the InChIKey of 4-methyl-N-(2-methylphenyl)-1,3-oxazole-5-carboxamide?
The InChIKey is RHMPONHOKPTRDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O2/c1-8-5-3-4-6-10(8)14-12(15)11-9(2)13-7-16-11/h3-7H,1-2H3,(H,14,15).
What are the key properties of 4-methyl-N-(2-methylphenyl)-1,3-oxazole-5-carboxamide?
4-methyl-N-(2-methylphenyl)-1,3-oxazole-5-carboxamide has a molecular weight of 216.24 g/mol, XLogP of 2.54, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(2-methylphenyl)-1,3-oxazole-5-carboxamide is sourced from PubChem (CID 5307543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).