N-tert-butyl-2-[2-(1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide

C16H18N4O2 — CID 16836201

IUPACN-tert-butyl-2-[2-(1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide
SMILESCC(C)(C)NC(=O)Cn1c(-c2nnco2)cc2ccccc21
InChIInChI=1S/C16H18N4O2/c1-16(2,3)18-14(21)9-20-12-7-5-4-6-11(12)8-13(20)15-19-17-10-22-15/h4-8,10H,9H2,1-3H3,(H,18,21)
InChIKeyVULSWXHYLMXEBB-UHFFFAOYSA-N
MW298.35 g/mol
LogP2.61
Rot. Bonds3

About N-tert-butyl-2-[2-(1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide

N-tert-butyl-2-[2-(1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide (PubChem CID 16836201) has the molecular formula C16H18N4O2 and a molecular weight of 298.35 g/mol. Its IUPAC name is N-tert-butyl-2-[2-(1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide.

Molecular Properties

Compound NameN-tert-butyl-2-[2-(1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide
PubChem CID16836201
Molecular FormulaC16H18N4O2
Molecular Weight298.35 g/mol
Exact Mass298.14
IUPAC NameN-tert-butyl-2-[2-(1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide
SMILESCC(C)(C)NC(=O)Cn1c(-c2nnco2)cc2ccccc21
InChIInChI=1S/C16H18N4O2/c1-16(2,3)18-14(21)9-20-12-7-5-4-6-11(12)8-13(20)15-19-17-10-22-15/h4-8,10H,9H2,1-3H3,(H,18,21)
InChIKeyVULSWXHYLMXEBB-UHFFFAOYSA-N
XLogP2.61
TPSA72.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.35
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-tert-butyl-2-[2-(1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-[2-(1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide?
The IUPAC name of N-tert-butyl-2-[2-(1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide (CID 16836201) is N-tert-butyl-2-[2-(1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide.
What is the SMILES notation for N-tert-butyl-2-[2-(1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide?
The canonical SMILES for N-tert-butyl-2-[2-(1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide is CC(C)(C)NC(=O)Cn1c(-c2nnco2)cc2ccccc21.
What is the InChIKey of N-tert-butyl-2-[2-(1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide?
The InChIKey is VULSWXHYLMXEBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4O2/c1-16(2,3)18-14(21)9-20-12-7-5-4-6-11(12)8-13(20)15-19-17-10-22-15/h4-8,10H,9H2,1-3H3,(H,18,21).
What are the key properties of N-tert-butyl-2-[2-(1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide?
N-tert-butyl-2-[2-(1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide has a molecular weight of 298.35 g/mol, XLogP of 2.61, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-[2-(1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide is sourced from PubChem (CID 16836201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).