(3-benzyl-1,2,4-oxadiazol-5-yl)-[1-(2-morpholin-4-ylethyl)indol-3-yl]methanone

C24H24N4O3 — CID 24851062

IUPAC(3-benzyl-1,2,4-oxadiazol-5-yl)-[1-(2-morpholin-4-ylethyl)indol-3-yl]methanone
SMILESO=C(c1nc(Cc2ccccc2)no1)c1cn(CCN2CCOCC2)c2ccccc12
InChIInChI=1S/C24H24N4O3/c29-23(24-25-22(26-31-24)16-18-6-2-1-3-7-18)20-17-28(21-9-5-4-8-19(20)21)11-10-27-12-14-30-15-13-27/h1-9,17H,10-16H2
InChIKeySHXZECJEMGEVTI-UHFFFAOYSA-N
MW416.48 g/mol
LogP3.18
Rot. Bonds7

About (3-benzyl-1,2,4-oxadiazol-5-yl)-[1-(2-morpholin-4-ylethyl)indol-3-yl]methanone

(3-benzyl-1,2,4-oxadiazol-5-yl)-[1-(2-morpholin-4-ylethyl)indol-3-yl]methanone (PubChem CID 24851062) has the molecular formula C24H24N4O3 and a molecular weight of 416.48 g/mol. Its IUPAC name is (3-benzyl-1,2,4-oxadiazol-5-yl)-[1-(2-morpholin-4-ylethyl)indol-3-yl]methanone.

Molecular Properties

Compound Name(3-benzyl-1,2,4-oxadiazol-5-yl)-[1-(2-morpholin-4-ylethyl)indol-3-yl]methanone
PubChem CID24851062
Molecular FormulaC24H24N4O3
Molecular Weight416.48 g/mol
Exact Mass416.18
IUPAC Name(3-benzyl-1,2,4-oxadiazol-5-yl)-[1-(2-morpholin-4-ylethyl)indol-3-yl]methanone
SMILESO=C(c1nc(Cc2ccccc2)no1)c1cn(CCN2CCOCC2)c2ccccc12
InChIInChI=1S/C24H24N4O3/c29-23(24-25-22(26-31-24)16-18-6-2-1-3-7-18)20-17-28(21-9-5-4-8-19(20)21)11-10-27-12-14-30-15-13-27/h1-9,17H,10-16H2
InChIKeySHXZECJEMGEVTI-UHFFFAOYSA-N
XLogP3.18
TPSA73.39 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.48
LogP ≤ 53.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze (3-benzyl-1,2,4-oxadiazol-5-yl)-[1-(2-morpholin-4-ylethyl)indol-3-yl]methanone 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 (3-benzyl-1,2,4-oxadiazol-5-yl)-[1-(2-morpholin-4-ylethyl)indol-3-yl]methanone?
The IUPAC name of (3-benzyl-1,2,4-oxadiazol-5-yl)-[1-(2-morpholin-4-ylethyl)indol-3-yl]methanone (CID 24851062) is (3-benzyl-1,2,4-oxadiazol-5-yl)-[1-(2-morpholin-4-ylethyl)indol-3-yl]methanone.
What is the SMILES notation for (3-benzyl-1,2,4-oxadiazol-5-yl)-[1-(2-morpholin-4-ylethyl)indol-3-yl]methanone?
The canonical SMILES for (3-benzyl-1,2,4-oxadiazol-5-yl)-[1-(2-morpholin-4-ylethyl)indol-3-yl]methanone is O=C(c1nc(Cc2ccccc2)no1)c1cn(CCN2CCOCC2)c2ccccc12.
What is the InChIKey of (3-benzyl-1,2,4-oxadiazol-5-yl)-[1-(2-morpholin-4-ylethyl)indol-3-yl]methanone?
The InChIKey is SHXZECJEMGEVTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N4O3/c29-23(24-25-22(26-31-24)16-18-6-2-1-3-7-18)20-17-28(21-9-5-4-8-19(20)21)11-10-27-12-14-30-15-13-27/h1-9,17H,10-16H2.
What are the key properties of (3-benzyl-1,2,4-oxadiazol-5-yl)-[1-(2-morpholin-4-ylethyl)indol-3-yl]methanone?
(3-benzyl-1,2,4-oxadiazol-5-yl)-[1-(2-morpholin-4-ylethyl)indol-3-yl]methanone has a molecular weight of 416.48 g/mol, XLogP of 3.18, 7 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (3-benzyl-1,2,4-oxadiazol-5-yl)-[1-(2-morpholin-4-ylethyl)indol-3-yl]methanone is sourced from PubChem (CID 24851062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).