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

C11H10N2O2 — CID 142673231

IUPAC3-methyl-5-(1,3-oxazol-2-yl)benzamide
SMILESCc1cc(C(N)=O)cc(-c2ncco2)c1
InChIInChI=1S/C11H10N2O2/c1-7-4-8(10(12)14)6-9(5-7)11-13-2-3-15-11/h2-6H,1H3,(H2,12,14)
InChIKeyLBPQHUJDLKZLTJ-UHFFFAOYSA-N
MW202.21 g/mol
LogP1.75
Rot. Bonds2

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

3-methyl-5-(1,3-oxazol-2-yl)benzamide (PubChem CID 142673231) has the molecular formula C11H10N2O2 and a molecular weight of 202.21 g/mol. Its IUPAC name is 3-methyl-5-(1,3-oxazol-2-yl)benzamide.

Molecular Properties

Compound Name3-methyl-5-(1,3-oxazol-2-yl)benzamide
PubChem CID142673231
Molecular FormulaC11H10N2O2
Molecular Weight202.21 g/mol
Exact Mass202.07
IUPAC Name3-methyl-5-(1,3-oxazol-2-yl)benzamide
SMILESCc1cc(C(N)=O)cc(-c2ncco2)c1
InChIInChI=1S/C11H10N2O2/c1-7-4-8(10(12)14)6-9(5-7)11-13-2-3-15-11/h2-6H,1H3,(H2,12,14)
InChIKeyLBPQHUJDLKZLTJ-UHFFFAOYSA-N
XLogP1.75
TPSA69.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.21
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-5-(1,3-oxazol-2-yl)benzamide?
The IUPAC name of 3-methyl-5-(1,3-oxazol-2-yl)benzamide (CID 142673231) is 3-methyl-5-(1,3-oxazol-2-yl)benzamide.
What is the SMILES notation for 3-methyl-5-(1,3-oxazol-2-yl)benzamide?
The canonical SMILES for 3-methyl-5-(1,3-oxazol-2-yl)benzamide is Cc1cc(C(N)=O)cc(-c2ncco2)c1.
What is the InChIKey of 3-methyl-5-(1,3-oxazol-2-yl)benzamide?
The InChIKey is LBPQHUJDLKZLTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O2/c1-7-4-8(10(12)14)6-9(5-7)11-13-2-3-15-11/h2-6H,1H3,(H2,12,14).
What are the key properties of 3-methyl-5-(1,3-oxazol-2-yl)benzamide?
3-methyl-5-(1,3-oxazol-2-yl)benzamide has a molecular weight of 202.21 g/mol, XLogP of 1.75, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-5-(1,3-oxazol-2-yl)benzamide is sourced from PubChem (CID 142673231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).