[3-(2-phenyl-1,3-thiazol-4-yl)indolizin-1-yl]-pyrrolidin-1-ylmethanone

C22H19N3OS — CID 97446884

IUPAC[3-(2-phenyl-1,3-thiazol-4-yl)indolizin-1-yl]-pyrrolidin-1-ylmethanone
SMILESO=C(c1cc(-c2csc(-c3ccccc3)n2)n2ccccc12)N1CCCC1
InChIInChI=1S/C22H19N3OS/c26-22(24-11-6-7-12-24)17-14-20(25-13-5-4-10-19(17)25)18-15-27-21(23-18)16-8-2-1-3-9-16/h1-5,8-10,13-15H,6-7,11-12H2
InChIKeyDGELMDMCQOYMDC-UHFFFAOYSA-N
MW373.48 g/mol
LogP4.97
Rot. Bonds3

About [3-(2-phenyl-1,3-thiazol-4-yl)indolizin-1-yl]-pyrrolidin-1-ylmethanone

[3-(2-phenyl-1,3-thiazol-4-yl)indolizin-1-yl]-pyrrolidin-1-ylmethanone (PubChem CID 97446884) has the molecular formula C22H19N3OS and a molecular weight of 373.48 g/mol. Its IUPAC name is [3-(2-phenyl-1,3-thiazol-4-yl)indolizin-1-yl]-pyrrolidin-1-ylmethanone.

Molecular Properties

Compound Name[3-(2-phenyl-1,3-thiazol-4-yl)indolizin-1-yl]-pyrrolidin-1-ylmethanone
PubChem CID97446884
Molecular FormulaC22H19N3OS
Molecular Weight373.48 g/mol
Exact Mass373.12
IUPAC Name[3-(2-phenyl-1,3-thiazol-4-yl)indolizin-1-yl]-pyrrolidin-1-ylmethanone
SMILESO=C(c1cc(-c2csc(-c3ccccc3)n2)n2ccccc12)N1CCCC1
InChIInChI=1S/C22H19N3OS/c26-22(24-11-6-7-12-24)17-14-20(25-13-5-4-10-19(17)25)18-15-27-21(23-18)16-8-2-1-3-9-16/h1-5,8-10,13-15H,6-7,11-12H2
InChIKeyDGELMDMCQOYMDC-UHFFFAOYSA-N
XLogP4.97
TPSA37.61 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.48
LogP ≤ 54.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze [3-(2-phenyl-1,3-thiazol-4-yl)indolizin-1-yl]-pyrrolidin-1-ylmethanone 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

(4-methylpiperazin-1-yl)-[3-[2-(2-methyl-1,3-thiazol-4-yl)-1,3-thiazol-4-yl]indolizin-1-yl]methanone
CID 97446871
[3-[2-(3-chlorophenyl)-1,3-thiazol-4-yl]indolizin-1-yl]-[(3R)-3-(dimethylamino)pyrrolidin-1-yl]methanone
CID 97446891
3-[2-(2-methyl-1,3-thiazol-4-yl)-1,3-thiazol-4-yl]indolizine-1-carboxylic acid
CID 134069675
[3-[2-methyl-1-(1,3-thiazol-2-yl)imidazol-4-yl]indolizin-1-yl]-pyrrolidin-1-ylmethanone
CID 97410696
[3-(2-benzyl-1,3-thiazol-4-yl)indolizin-1-yl]-[(2S,6S)-2,6-dimethylmorpholin-4-yl]methanone
CID 97446879
3-(2-ethyl-1,3-thiazol-4-yl)indolizine-1-carboxylic acid
CID 121229439
1-[4-[2-methyl-1-(2-phenylethyl)-5-(2-phenyl-1,3-thiazol-4-yl)pyrrole-3-carbonyl]piperazin-1-yl]ethanone
CID 134082469
2-[4-(2-phenyl-1,3-thiazole-4-carbonyl)piperazin-1-yl]-1-pyrrolidin-1-ylethanone
CID 51255758
[3-[1-(cyclopropylmethyl)pyrazol-3-yl]indolizin-1-yl]-(4-pyrrolidin-1-ylpiperidin-1-yl)methanone
CID 97446734
N-methyl-2-[4-[2-methyl-1-(2-phenylethyl)-5-(2-phenyl-1,3-thiazol-4-yl)pyrrole-3-carbonyl]piperazin-1-yl]-N-phenylacetamide
CID 134082566
(4-methyl-1,4-diazepan-1-yl)-[3-(2-methyl-1-propan-2-ylimidazol-4-yl)indolizin-1-yl]methanone;2,2,2-trifluoroacetic acid
CID 155843445
3-(2-methyl-1,3-thiazol-4-yl)-N-(2-phenylethyl)indolizine-1-carboxamide
CID 97446816

Frequently Asked Questions

What is the IUPAC name of [3-(2-phenyl-1,3-thiazol-4-yl)indolizin-1-yl]-pyrrolidin-1-ylmethanone?
The IUPAC name of [3-(2-phenyl-1,3-thiazol-4-yl)indolizin-1-yl]-pyrrolidin-1-ylmethanone (CID 97446884) is [3-(2-phenyl-1,3-thiazol-4-yl)indolizin-1-yl]-pyrrolidin-1-ylmethanone.
What is the SMILES notation for [3-(2-phenyl-1,3-thiazol-4-yl)indolizin-1-yl]-pyrrolidin-1-ylmethanone?
The canonical SMILES for [3-(2-phenyl-1,3-thiazol-4-yl)indolizin-1-yl]-pyrrolidin-1-ylmethanone is O=C(c1cc(-c2csc(-c3ccccc3)n2)n2ccccc12)N1CCCC1.
What is the InChIKey of [3-(2-phenyl-1,3-thiazol-4-yl)indolizin-1-yl]-pyrrolidin-1-ylmethanone?
The InChIKey is DGELMDMCQOYMDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N3OS/c26-22(24-11-6-7-12-24)17-14-20(25-13-5-4-10-19(17)25)18-15-27-21(23-18)16-8-2-1-3-9-16/h1-5,8-10,13-15H,6-7,11-12H2.
What are the key properties of [3-(2-phenyl-1,3-thiazol-4-yl)indolizin-1-yl]-pyrrolidin-1-ylmethanone?
[3-(2-phenyl-1,3-thiazol-4-yl)indolizin-1-yl]-pyrrolidin-1-ylmethanone has a molecular weight of 373.48 g/mol, XLogP of 4.97, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(2-phenyl-1,3-thiazol-4-yl)indolizin-1-yl]-pyrrolidin-1-ylmethanone is sourced from PubChem (CID 97446884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).