1-[(2R)-2-[3-(2,3-dihydro-1H-indol-5-yl)-1,2,4-oxadiazol-5-yl]piperazin-1-yl]-2-phenoxyethanone

C22H23N5O3 — CID 69263901

IUPAC1-[(2R)-2-[3-(2,3-dihydro-1H-indol-5-yl)-1,2,4-oxadiazol-5-yl]piperazin-1-yl]-2-phenoxyethanone
SMILESO=C(COc1ccccc1)N1CCNC[C@@H]1c1nc(-c2ccc3c(c2)CCN3)no1
InChIInChI=1S/C22H23N5O3/c28-20(14-29-17-4-2-1-3-5-17)27-11-10-23-13-19(27)22-25-21(26-30-22)16-6-7-18-15(12-16)8-9-24-18/h1-7,12,19,23-24H,8-11,13-14H2/t19-/m1/s1
InChIKeyOMZYQLQCLCJETI-LJQANCHMSA-N
MW405.46 g/mol
LogP2.26
Rot. Bonds5

About 1-[(2R)-2-[3-(2,3-dihydro-1H-indol-5-yl)-1,2,4-oxadiazol-5-yl]piperazin-1-yl]-2-phenoxyethanone

1-[(2R)-2-[3-(2,3-dihydro-1H-indol-5-yl)-1,2,4-oxadiazol-5-yl]piperazin-1-yl]-2-phenoxyethanone (PubChem CID 69263901) has the molecular formula C22H23N5O3 and a molecular weight of 405.46 g/mol. Its IUPAC name is 1-[(2R)-2-[3-(2,3-dihydro-1H-indol-5-yl)-1,2,4-oxadiazol-5-yl]piperazin-1-yl]-2-phenoxyethanone.

Molecular Properties

Compound Name1-[(2R)-2-[3-(2,3-dihydro-1H-indol-5-yl)-1,2,4-oxadiazol-5-yl]piperazin-1-yl]-2-phenoxyethanone
PubChem CID69263901
Molecular FormulaC22H23N5O3
Molecular Weight405.46 g/mol
Exact Mass405.18
IUPAC Name1-[(2R)-2-[3-(2,3-dihydro-1H-indol-5-yl)-1,2,4-oxadiazol-5-yl]piperazin-1-yl]-2-phenoxyethanone
SMILESO=C(COc1ccccc1)N1CCNC[C@@H]1c1nc(-c2ccc3c(c2)CCN3)no1
InChIInChI=1S/C22H23N5O3/c28-20(14-29-17-4-2-1-3-5-17)27-11-10-23-13-19(27)22-25-21(26-30-22)16-6-7-18-15(12-16)8-9-24-18/h1-7,12,19,23-24H,8-11,13-14H2/t19-/m1/s1
InChIKeyOMZYQLQCLCJETI-LJQANCHMSA-N
XLogP2.26
TPSA92.52 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.46
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 1-[(2R)-2-[3-(2,3-dihydro-1H-indol-5-yl)-1,2,4-oxadiazol-5-yl]piperazin-1-yl]-2-phenoxyethanone with MolForge

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

Launch Full Analysis

Related Compounds

1-[(2R)-2-[3-(1H-indazol-5-yl)-1,2,4-oxadiazol-5-yl]piperazin-1-yl]-2-phenoxyethanone
CID 68688015
1-[(2R)-2-[3-(2,3-dihydro-1H-indol-6-yl)-1H-1,2,4-triazol-5-yl]piperidin-1-yl]-2-phenoxyethanone
CID 69263763
cyclopropyl-[2-(3-phenyl-1,2,4-oxadiazol-5-yl)piperazin-1-yl]methanone
CID 44783596
2-phenoxy-1-(2-phenylpiperazin-1-yl)ethanone
CID 82251696
1-[(2S)-2-[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]-2-phenoxyethanone
CID 7356627
2-phenoxy-1-[(2R)-2-[3-(2-pyrazol-1-yl-4-pyridinyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]ethanone
CID 68686836
N-[2-fluoro-5-[5-[(2R)-1-(2-phenoxyacetyl)piperidin-2-yl]-1,2,4-oxadiazol-3-yl]phenyl]acetamide
CID 68686400
N-[2-fluoro-5-[5-[1-(2-phenoxyacetyl)piperidin-2-yl]-1,2,4-oxadiazol-3-yl]phenyl]acetamide
CID 68686403
3-[5-[4-acetyl-1-(2-phenoxyacetyl)piperazin-2-yl]-1,2,4-oxadiazol-3-yl]benzoic acid
CID 68687585
1-[4-acetyl-2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]piperazin-1-yl]-2-phenoxyethanone
CID 68688695
2-phenoxy-1-[2-[3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl]piperidin-1-yl]ethanone
CID 68686960
N-[3-[5-[(2R)-1-(2-phenoxyacetyl)piperazin-2-yl]-1H-1,2,4-triazol-3-yl]phenyl]acetamide
CID 69029082

Frequently Asked Questions

What is the IUPAC name of 1-[(2R)-2-[3-(2,3-dihydro-1H-indol-5-yl)-1,2,4-oxadiazol-5-yl]piperazin-1-yl]-2-phenoxyethanone?
The IUPAC name of 1-[(2R)-2-[3-(2,3-dihydro-1H-indol-5-yl)-1,2,4-oxadiazol-5-yl]piperazin-1-yl]-2-phenoxyethanone (CID 69263901) is 1-[(2R)-2-[3-(2,3-dihydro-1H-indol-5-yl)-1,2,4-oxadiazol-5-yl]piperazin-1-yl]-2-phenoxyethanone.
What is the SMILES notation for 1-[(2R)-2-[3-(2,3-dihydro-1H-indol-5-yl)-1,2,4-oxadiazol-5-yl]piperazin-1-yl]-2-phenoxyethanone?
The canonical SMILES for 1-[(2R)-2-[3-(2,3-dihydro-1H-indol-5-yl)-1,2,4-oxadiazol-5-yl]piperazin-1-yl]-2-phenoxyethanone is O=C(COc1ccccc1)N1CCNC[C@@H]1c1nc(-c2ccc3c(c2)CCN3)no1.
What is the InChIKey of 1-[(2R)-2-[3-(2,3-dihydro-1H-indol-5-yl)-1,2,4-oxadiazol-5-yl]piperazin-1-yl]-2-phenoxyethanone?
The InChIKey is OMZYQLQCLCJETI-LJQANCHMSA-N. The full InChI is InChI=1S/C22H23N5O3/c28-20(14-29-17-4-2-1-3-5-17)27-11-10-23-13-19(27)22-25-21(26-30-22)16-6-7-18-15(12-16)8-9-24-18/h1-7,12,19,23-24H,8-11,13-14H2/t19-/m1/s1.
What are the key properties of 1-[(2R)-2-[3-(2,3-dihydro-1H-indol-5-yl)-1,2,4-oxadiazol-5-yl]piperazin-1-yl]-2-phenoxyethanone?
1-[(2R)-2-[3-(2,3-dihydro-1H-indol-5-yl)-1,2,4-oxadiazol-5-yl]piperazin-1-yl]-2-phenoxyethanone has a molecular weight of 405.46 g/mol, XLogP of 2.26, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2R)-2-[3-(2,3-dihydro-1H-indol-5-yl)-1,2,4-oxadiazol-5-yl]piperazin-1-yl]-2-phenoxyethanone is sourced from PubChem (CID 69263901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).