2-[2-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide

C13H12N4O2 — CID 16820282

IUPAC2-[2-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide
SMILESCc1nnc(-c2cc3ccccc3n2CC(N)=O)o1
InChIInChI=1S/C13H12N4O2/c1-8-15-16-13(19-8)11-6-9-4-2-3-5-10(9)17(11)7-12(14)18/h2-6H,7H2,1H3,(H2,14,18)
InChIKeySEZOJPQLAONAKR-UHFFFAOYSA-N
MW256.26 g/mol
LogP1.49
Rot. Bonds3

About 2-[2-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide

2-[2-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide (PubChem CID 16820282) has the molecular formula C13H12N4O2 and a molecular weight of 256.26 g/mol. Its IUPAC name is 2-[2-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide.

Molecular Properties

Compound Name2-[2-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide
PubChem CID16820282
Molecular FormulaC13H12N4O2
Molecular Weight256.26 g/mol
Exact Mass256.10
IUPAC Name2-[2-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide
SMILESCc1nnc(-c2cc3ccccc3n2CC(N)=O)o1
InChIInChI=1S/C13H12N4O2/c1-8-15-16-13(19-8)11-6-9-4-2-3-5-10(9)17(11)7-12(14)18/h2-6H,7H2,1H3,(H2,14,18)
InChIKeySEZOJPQLAONAKR-UHFFFAOYSA-N
XLogP1.49
TPSA86.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.26
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide?
The IUPAC name of 2-[2-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide (CID 16820282) is 2-[2-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide.
What is the SMILES notation for 2-[2-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide?
The canonical SMILES for 2-[2-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide is Cc1nnc(-c2cc3ccccc3n2CC(N)=O)o1.
What is the InChIKey of 2-[2-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide?
The InChIKey is SEZOJPQLAONAKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N4O2/c1-8-15-16-13(19-8)11-6-9-4-2-3-5-10(9)17(11)7-12(14)18/h2-6H,7H2,1H3,(H2,14,18).
What are the key properties of 2-[2-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide?
2-[2-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide has a molecular weight of 256.26 g/mol, XLogP of 1.49, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(5-methyl-1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide is sourced from PubChem (CID 16820282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).