2-methyl-5-(5-methyl-1,2-oxazol-3-yl)benzamide

C12H12N2O2 — CID 68604813

IUPAC2-methyl-5-(5-methyl-1,2-oxazol-3-yl)benzamide
SMILESCc1cc(-c2ccc(C)c(C(N)=O)c2)no1
InChIInChI=1S/C12H12N2O2/c1-7-3-4-9(6-10(7)12(13)15)11-5-8(2)16-14-11/h3-6H,1-2H3,(H2,13,15)
InChIKeyUTKSROZPHLHFNS-UHFFFAOYSA-N
MW216.24 g/mol
LogP2.06
Rot. Bonds2

About 2-methyl-5-(5-methyl-1,2-oxazol-3-yl)benzamide

2-methyl-5-(5-methyl-1,2-oxazol-3-yl)benzamide (PubChem CID 68604813) has the molecular formula C12H12N2O2 and a molecular weight of 216.24 g/mol. Its IUPAC name is 2-methyl-5-(5-methyl-1,2-oxazol-3-yl)benzamide.

Molecular Properties

Compound Name2-methyl-5-(5-methyl-1,2-oxazol-3-yl)benzamide
PubChem CID68604813
Molecular FormulaC12H12N2O2
Molecular Weight216.24 g/mol
Exact Mass216.09
IUPAC Name2-methyl-5-(5-methyl-1,2-oxazol-3-yl)benzamide
SMILESCc1cc(-c2ccc(C)c(C(N)=O)c2)no1
InChIInChI=1S/C12H12N2O2/c1-7-3-4-9(6-10(7)12(13)15)11-5-8(2)16-14-11/h3-6H,1-2H3,(H2,13,15)
InChIKeyUTKSROZPHLHFNS-UHFFFAOYSA-N
XLogP2.06
TPSA69.12 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 ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-(5-methyl-1,2-oxazol-3-yl)benzamide?
The IUPAC name of 2-methyl-5-(5-methyl-1,2-oxazol-3-yl)benzamide (CID 68604813) is 2-methyl-5-(5-methyl-1,2-oxazol-3-yl)benzamide.
What is the SMILES notation for 2-methyl-5-(5-methyl-1,2-oxazol-3-yl)benzamide?
The canonical SMILES for 2-methyl-5-(5-methyl-1,2-oxazol-3-yl)benzamide is Cc1cc(-c2ccc(C)c(C(N)=O)c2)no1.
What is the InChIKey of 2-methyl-5-(5-methyl-1,2-oxazol-3-yl)benzamide?
The InChIKey is UTKSROZPHLHFNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O2/c1-7-3-4-9(6-10(7)12(13)15)11-5-8(2)16-14-11/h3-6H,1-2H3,(H2,13,15).
What are the key properties of 2-methyl-5-(5-methyl-1,2-oxazol-3-yl)benzamide?
2-methyl-5-(5-methyl-1,2-oxazol-3-yl)benzamide has a molecular weight of 216.24 g/mol, XLogP of 2.06, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-(5-methyl-1,2-oxazol-3-yl)benzamide is sourced from PubChem (CID 68604813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).