2-amino-N-(5-methyl-1,3,4-oxadiazol-2-yl)-2-(4-methylphenyl)acetamide

C12H14N4O2 — CID 106312742

IUPAC2-amino-N-(5-methyl-1,3,4-oxadiazol-2-yl)-2-(4-methylphenyl)acetamide
SMILESCc1ccc(C(N)C(=O)Nc2nnc(C)o2)cc1
InChIInChI=1S/C12H14N4O2/c1-7-3-5-9(6-4-7)10(13)11(17)14-12-16-15-8(2)18-12/h3-6,10H,13H2,1-2H3,(H,14,16,17)
InChIKeyPFDJWPIAEWYDDO-UHFFFAOYSA-N
MW246.27 g/mol
LogP1.32
Rot. Bonds3

About 2-amino-N-(5-methyl-1,3,4-oxadiazol-2-yl)-2-(4-methylphenyl)acetamide

2-amino-N-(5-methyl-1,3,4-oxadiazol-2-yl)-2-(4-methylphenyl)acetamide (PubChem CID 106312742) has the molecular formula C12H14N4O2 and a molecular weight of 246.27 g/mol. Its IUPAC name is 2-amino-N-(5-methyl-1,3,4-oxadiazol-2-yl)-2-(4-methylphenyl)acetamide.

Molecular Properties

Compound Name2-amino-N-(5-methyl-1,3,4-oxadiazol-2-yl)-2-(4-methylphenyl)acetamide
PubChem CID106312742
Molecular FormulaC12H14N4O2
Molecular Weight246.27 g/mol
Exact Mass246.11
IUPAC Name2-amino-N-(5-methyl-1,3,4-oxadiazol-2-yl)-2-(4-methylphenyl)acetamide
SMILESCc1ccc(C(N)C(=O)Nc2nnc(C)o2)cc1
InChIInChI=1S/C12H14N4O2/c1-7-3-5-9(6-4-7)10(13)11(17)14-12-16-15-8(2)18-12/h3-6,10H,13H2,1-2H3,(H,14,16,17)
InChIKeyPFDJWPIAEWYDDO-UHFFFAOYSA-N
XLogP1.32
TPSA94.04 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.27
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(5-methyl-1,3,4-oxadiazol-2-yl)-2-(4-methylphenyl)acetamide?
The IUPAC name of 2-amino-N-(5-methyl-1,3,4-oxadiazol-2-yl)-2-(4-methylphenyl)acetamide (CID 106312742) is 2-amino-N-(5-methyl-1,3,4-oxadiazol-2-yl)-2-(4-methylphenyl)acetamide.
What is the SMILES notation for 2-amino-N-(5-methyl-1,3,4-oxadiazol-2-yl)-2-(4-methylphenyl)acetamide?
The canonical SMILES for 2-amino-N-(5-methyl-1,3,4-oxadiazol-2-yl)-2-(4-methylphenyl)acetamide is Cc1ccc(C(N)C(=O)Nc2nnc(C)o2)cc1.
What is the InChIKey of 2-amino-N-(5-methyl-1,3,4-oxadiazol-2-yl)-2-(4-methylphenyl)acetamide?
The InChIKey is PFDJWPIAEWYDDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O2/c1-7-3-5-9(6-4-7)10(13)11(17)14-12-16-15-8(2)18-12/h3-6,10H,13H2,1-2H3,(H,14,16,17).
What are the key properties of 2-amino-N-(5-methyl-1,3,4-oxadiazol-2-yl)-2-(4-methylphenyl)acetamide?
2-amino-N-(5-methyl-1,3,4-oxadiazol-2-yl)-2-(4-methylphenyl)acetamide has a molecular weight of 246.27 g/mol, XLogP of 1.32, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(5-methyl-1,3,4-oxadiazol-2-yl)-2-(4-methylphenyl)acetamide is sourced from PubChem (CID 106312742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).