1-(2,3-dihydroindol-1-yl)-2-[2-(5-propyl-1,3,4-oxadiazol-2-yl)indol-1-yl]ethanone

C23H22N4O2 — CID 16835963

IUPAC1-(2,3-dihydroindol-1-yl)-2-[2-(5-propyl-1,3,4-oxadiazol-2-yl)indol-1-yl]ethanone
SMILESCCCc1nnc(-c2cc3ccccc3n2CC(=O)N2CCc3ccccc32)o1
InChIInChI=1S/C23H22N4O2/c1-2-7-21-24-25-23(29-21)20-14-17-9-4-6-11-19(17)27(20)15-22(28)26-13-12-16-8-3-5-10-18(16)26/h3-6,8-11,14H,2,7,12-13,15H2,1H3
InChIKeyVIZRWLKVBCURMV-UHFFFAOYSA-N
MW386.46 g/mol
LogP4.23
Rot. Bonds5

About 1-(2,3-dihydroindol-1-yl)-2-[2-(5-propyl-1,3,4-oxadiazol-2-yl)indol-1-yl]ethanone

1-(2,3-dihydroindol-1-yl)-2-[2-(5-propyl-1,3,4-oxadiazol-2-yl)indol-1-yl]ethanone (PubChem CID 16835963) has the molecular formula C23H22N4O2 and a molecular weight of 386.46 g/mol. Its IUPAC name is 1-(2,3-dihydroindol-1-yl)-2-[2-(5-propyl-1,3,4-oxadiazol-2-yl)indol-1-yl]ethanone.

Molecular Properties

Compound Name1-(2,3-dihydroindol-1-yl)-2-[2-(5-propyl-1,3,4-oxadiazol-2-yl)indol-1-yl]ethanone
PubChem CID16835963
Molecular FormulaC23H22N4O2
Molecular Weight386.46 g/mol
Exact Mass386.17
IUPAC Name1-(2,3-dihydroindol-1-yl)-2-[2-(5-propyl-1,3,4-oxadiazol-2-yl)indol-1-yl]ethanone
SMILESCCCc1nnc(-c2cc3ccccc3n2CC(=O)N2CCc3ccccc32)o1
InChIInChI=1S/C23H22N4O2/c1-2-7-21-24-25-23(29-21)20-14-17-9-4-6-11-19(17)27(20)15-22(28)26-13-12-16-8-3-5-10-18(16)26/h3-6,8-11,14H,2,7,12-13,15H2,1H3
InChIKeyVIZRWLKVBCURMV-UHFFFAOYSA-N
XLogP4.23
TPSA64.16 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms29
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.46
LogP ≤ 54.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydroindol-1-yl)-2-[2-(5-propyl-1,3,4-oxadiazol-2-yl)indol-1-yl]ethanone?
The IUPAC name of 1-(2,3-dihydroindol-1-yl)-2-[2-(5-propyl-1,3,4-oxadiazol-2-yl)indol-1-yl]ethanone (CID 16835963) is 1-(2,3-dihydroindol-1-yl)-2-[2-(5-propyl-1,3,4-oxadiazol-2-yl)indol-1-yl]ethanone.
What is the SMILES notation for 1-(2,3-dihydroindol-1-yl)-2-[2-(5-propyl-1,3,4-oxadiazol-2-yl)indol-1-yl]ethanone?
The canonical SMILES for 1-(2,3-dihydroindol-1-yl)-2-[2-(5-propyl-1,3,4-oxadiazol-2-yl)indol-1-yl]ethanone is CCCc1nnc(-c2cc3ccccc3n2CC(=O)N2CCc3ccccc32)o1.
What is the InChIKey of 1-(2,3-dihydroindol-1-yl)-2-[2-(5-propyl-1,3,4-oxadiazol-2-yl)indol-1-yl]ethanone?
The InChIKey is VIZRWLKVBCURMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N4O2/c1-2-7-21-24-25-23(29-21)20-14-17-9-4-6-11-19(17)27(20)15-22(28)26-13-12-16-8-3-5-10-18(16)26/h3-6,8-11,14H,2,7,12-13,15H2,1H3.
What are the key properties of 1-(2,3-dihydroindol-1-yl)-2-[2-(5-propyl-1,3,4-oxadiazol-2-yl)indol-1-yl]ethanone?
1-(2,3-dihydroindol-1-yl)-2-[2-(5-propyl-1,3,4-oxadiazol-2-yl)indol-1-yl]ethanone has a molecular weight of 386.46 g/mol, XLogP of 4.23, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydroindol-1-yl)-2-[2-(5-propyl-1,3,4-oxadiazol-2-yl)indol-1-yl]ethanone is sourced from PubChem (CID 16835963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).