2-[3-(1,3,4-oxadiazol-2-yl)indol-1-yl]-N-propan-2-ylacetamide

C15H16N4O2 — CID 53027926

IUPAC2-[3-(1,3,4-oxadiazol-2-yl)indol-1-yl]-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)Cn1cc(-c2nnco2)c2ccccc21
InChIInChI=1S/C15H16N4O2/c1-10(2)17-14(20)8-19-7-12(15-18-16-9-21-15)11-5-3-4-6-13(11)19/h3-7,9-10H,8H2,1-2H3,(H,17,20)
InChIKeyNWBCGCMNSVEZBE-UHFFFAOYSA-N
MW284.32 g/mol
LogP2.22
Rot. Bonds4

About 2-[3-(1,3,4-oxadiazol-2-yl)indol-1-yl]-N-propan-2-ylacetamide

2-[3-(1,3,4-oxadiazol-2-yl)indol-1-yl]-N-propan-2-ylacetamide (PubChem CID 53027926) has the molecular formula C15H16N4O2 and a molecular weight of 284.32 g/mol. Its IUPAC name is 2-[3-(1,3,4-oxadiazol-2-yl)indol-1-yl]-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-[3-(1,3,4-oxadiazol-2-yl)indol-1-yl]-N-propan-2-ylacetamide
PubChem CID53027926
Molecular FormulaC15H16N4O2
Molecular Weight284.32 g/mol
Exact Mass284.13
IUPAC Name2-[3-(1,3,4-oxadiazol-2-yl)indol-1-yl]-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)Cn1cc(-c2nnco2)c2ccccc21
InChIInChI=1S/C15H16N4O2/c1-10(2)17-14(20)8-19-7-12(15-18-16-9-21-15)11-5-3-4-6-13(11)19/h3-7,9-10H,8H2,1-2H3,(H,17,20)
InChIKeyNWBCGCMNSVEZBE-UHFFFAOYSA-N
XLogP2.22
TPSA72.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.32
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[3-(1,3,4-oxadiazol-2-yl)indol-1-yl]-N-propan-2-ylacetamide?
The IUPAC name of 2-[3-(1,3,4-oxadiazol-2-yl)indol-1-yl]-N-propan-2-ylacetamide (CID 53027926) is 2-[3-(1,3,4-oxadiazol-2-yl)indol-1-yl]-N-propan-2-ylacetamide.
What is the SMILES notation for 2-[3-(1,3,4-oxadiazol-2-yl)indol-1-yl]-N-propan-2-ylacetamide?
The canonical SMILES for 2-[3-(1,3,4-oxadiazol-2-yl)indol-1-yl]-N-propan-2-ylacetamide is CC(C)NC(=O)Cn1cc(-c2nnco2)c2ccccc21.
What is the InChIKey of 2-[3-(1,3,4-oxadiazol-2-yl)indol-1-yl]-N-propan-2-ylacetamide?
The InChIKey is NWBCGCMNSVEZBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O2/c1-10(2)17-14(20)8-19-7-12(15-18-16-9-21-15)11-5-3-4-6-13(11)19/h3-7,9-10H,8H2,1-2H3,(H,17,20).
What are the key properties of 2-[3-(1,3,4-oxadiazol-2-yl)indol-1-yl]-N-propan-2-ylacetamide?
2-[3-(1,3,4-oxadiazol-2-yl)indol-1-yl]-N-propan-2-ylacetamide has a molecular weight of 284.32 g/mol, XLogP of 2.22, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(1,3,4-oxadiazol-2-yl)indol-1-yl]-N-propan-2-ylacetamide is sourced from PubChem (CID 53027926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).