2-(3-methylphenyl)-N-(1,2-oxazol-3-yl)acetamide

C12H12N2O2 — CID 6467231

IUPAC2-(3-methylphenyl)-N-(1,2-oxazol-3-yl)acetamide
SMILESCc1cccc(CC(=O)Nc2ccon2)c1
InChIInChI=1S/C12H12N2O2/c1-9-3-2-4-10(7-9)8-12(15)13-11-5-6-16-14-11/h2-7H,8H2,1H3,(H,13,14,15)
InChIKeyAFEIJLUSZUKBHP-UHFFFAOYSA-N
MW216.24 g/mol
LogP2.16
Rot. Bonds3

About 2-(3-methylphenyl)-N-(1,2-oxazol-3-yl)acetamide

2-(3-methylphenyl)-N-(1,2-oxazol-3-yl)acetamide (PubChem CID 6467231) has the molecular formula C12H12N2O2 and a molecular weight of 216.24 g/mol. Its IUPAC name is 2-(3-methylphenyl)-N-(1,2-oxazol-3-yl)acetamide.

Molecular Properties

Compound Name2-(3-methylphenyl)-N-(1,2-oxazol-3-yl)acetamide
PubChem CID6467231
Molecular FormulaC12H12N2O2
Molecular Weight216.24 g/mol
Exact Mass216.09
IUPAC Name2-(3-methylphenyl)-N-(1,2-oxazol-3-yl)acetamide
SMILESCc1cccc(CC(=O)Nc2ccon2)c1
InChIInChI=1S/C12H12N2O2/c1-9-3-2-4-10(7-9)8-12(15)13-11-5-6-16-14-11/h2-7H,8H2,1H3,(H,13,14,15)
InChIKeyAFEIJLUSZUKBHP-UHFFFAOYSA-N
XLogP2.16
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.24
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(3-methylphenyl)-N-(1,2-oxazol-3-yl)acetamide?
The IUPAC name of 2-(3-methylphenyl)-N-(1,2-oxazol-3-yl)acetamide (CID 6467231) is 2-(3-methylphenyl)-N-(1,2-oxazol-3-yl)acetamide.
What is the SMILES notation for 2-(3-methylphenyl)-N-(1,2-oxazol-3-yl)acetamide?
The canonical SMILES for 2-(3-methylphenyl)-N-(1,2-oxazol-3-yl)acetamide is Cc1cccc(CC(=O)Nc2ccon2)c1.
What is the InChIKey of 2-(3-methylphenyl)-N-(1,2-oxazol-3-yl)acetamide?
The InChIKey is AFEIJLUSZUKBHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O2/c1-9-3-2-4-10(7-9)8-12(15)13-11-5-6-16-14-11/h2-7H,8H2,1H3,(H,13,14,15).
What are the key properties of 2-(3-methylphenyl)-N-(1,2-oxazol-3-yl)acetamide?
2-(3-methylphenyl)-N-(1,2-oxazol-3-yl)acetamide has a molecular weight of 216.24 g/mol, XLogP of 2.16, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methylphenyl)-N-(1,2-oxazol-3-yl)acetamide is sourced from PubChem (CID 6467231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).