[(3R)-3-imidazo[5,1-b][1,3]thiazol-7-ylpyrrolidin-1-yl]-(5-methyl-1,2-oxazol-3-yl)methanone

C14H14N4O2S — CID 124984909

IUPAC[(3R)-3-imidazo[5,1-b][1,3]thiazol-7-ylpyrrolidin-1-yl]-(5-methyl-1,2-oxazol-3-yl)methanone
SMILESCc1cc(C(=O)N2CC[C@@H](c3ncn4ccsc34)C2)no1
InChIInChI=1S/C14H14N4O2S/c1-9-6-11(16-20-9)13(19)17-3-2-10(7-17)12-14-18(8-15-12)4-5-21-14/h4-6,8,10H,2-3,7H2,1H3/t10-/m1/s1
InChIKeyNOAAIUDYZLATFT-SNVBAGLBSA-N
MW302.36 g/mol
LogP2.32
Rot. Bonds2

About [(3R)-3-imidazo[5,1-b][1,3]thiazol-7-ylpyrrolidin-1-yl]-(5-methyl-1,2-oxazol-3-yl)methanone

[(3R)-3-imidazo[5,1-b][1,3]thiazol-7-ylpyrrolidin-1-yl]-(5-methyl-1,2-oxazol-3-yl)methanone (PubChem CID 124984909) has the molecular formula C14H14N4O2S and a molecular weight of 302.36 g/mol. Its IUPAC name is [(3R)-3-imidazo[5,1-b][1,3]thiazol-7-ylpyrrolidin-1-yl]-(5-methyl-1,2-oxazol-3-yl)methanone.

Molecular Properties

Compound Name[(3R)-3-imidazo[5,1-b][1,3]thiazol-7-ylpyrrolidin-1-yl]-(5-methyl-1,2-oxazol-3-yl)methanone
PubChem CID124984909
Molecular FormulaC14H14N4O2S
Molecular Weight302.36 g/mol
Exact Mass302.08
IUPAC Name[(3R)-3-imidazo[5,1-b][1,3]thiazol-7-ylpyrrolidin-1-yl]-(5-methyl-1,2-oxazol-3-yl)methanone
SMILESCc1cc(C(=O)N2CC[C@@H](c3ncn4ccsc34)C2)no1
InChIInChI=1S/C14H14N4O2S/c1-9-6-11(16-20-9)13(19)17-3-2-10(7-17)12-14-18(8-15-12)4-5-21-14/h4-6,8,10H,2-3,7H2,1H3/t10-/m1/s1
InChIKeyNOAAIUDYZLATFT-SNVBAGLBSA-N
XLogP2.32
TPSA63.64 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.36
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze [(3R)-3-imidazo[5,1-b][1,3]thiazol-7-ylpyrrolidin-1-yl]-(5-methyl-1,2-oxazol-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

Related Compounds

[(3S)-3-imidazo[5,1-b][1,3]thiazol-7-ylpyrrolidin-1-yl]-(5-methylpyrazin-2-yl)methanone
CID 124976468
[(4aS,8aR)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-(5-methyl-1,2-oxazol-3-yl)methanone
CID 129366335
(4-chloropiperidin-1-yl)-(5-methyl-1,2-oxazol-3-yl)methanone
CID 66155616
(3-chloro-4-methylpiperidin-1-yl)-(5-methyl-1,2-oxazol-3-yl)methanone
CID 102961313
(4-bromopiperidin-1-yl)-(5-methyl-1,2-oxazol-3-yl)methanone
CID 80662471
(5-methyl-1,2-oxazol-3-yl)-[(3S)-3-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-1-yl]methanone
CID 30863871
[3-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-(5-methyl-1,2-oxazol-3-yl)methanone
CID 70755395
(4-amino-3-ethylpiperidin-1-yl)-(5-methyl-1,2-oxazol-3-yl)methanone
CID 81457893
(4-aminopiperidin-1-yl)-(5-methyl-1,2-oxazol-3-yl)methanone;hydrochloride
CID 72716281
(3,5-dimethylpiperidin-1-yl)-(5-methyl-1,2-oxazol-3-yl)methanone
CID 51072597
methyl 1-(5-methyl-1,2-oxazole-3-carbonyl)piperidine-3-carboxylate
CID 78919150
methyl 2-[(3R)-1-(5-methyl-1,2-oxazole-3-carbonyl)pyrrolidin-3-yl]sulfanylacetate
CID 99981951

Frequently Asked Questions

What is the IUPAC name of [(3R)-3-imidazo[5,1-b][1,3]thiazol-7-ylpyrrolidin-1-yl]-(5-methyl-1,2-oxazol-3-yl)methanone?
The IUPAC name of [(3R)-3-imidazo[5,1-b][1,3]thiazol-7-ylpyrrolidin-1-yl]-(5-methyl-1,2-oxazol-3-yl)methanone (CID 124984909) is [(3R)-3-imidazo[5,1-b][1,3]thiazol-7-ylpyrrolidin-1-yl]-(5-methyl-1,2-oxazol-3-yl)methanone.
What is the SMILES notation for [(3R)-3-imidazo[5,1-b][1,3]thiazol-7-ylpyrrolidin-1-yl]-(5-methyl-1,2-oxazol-3-yl)methanone?
The canonical SMILES for [(3R)-3-imidazo[5,1-b][1,3]thiazol-7-ylpyrrolidin-1-yl]-(5-methyl-1,2-oxazol-3-yl)methanone is Cc1cc(C(=O)N2CC[C@@H](c3ncn4ccsc34)C2)no1.
What is the InChIKey of [(3R)-3-imidazo[5,1-b][1,3]thiazol-7-ylpyrrolidin-1-yl]-(5-methyl-1,2-oxazol-3-yl)methanone?
The InChIKey is NOAAIUDYZLATFT-SNVBAGLBSA-N. The full InChI is InChI=1S/C14H14N4O2S/c1-9-6-11(16-20-9)13(19)17-3-2-10(7-17)12-14-18(8-15-12)4-5-21-14/h4-6,8,10H,2-3,7H2,1H3/t10-/m1/s1.
What are the key properties of [(3R)-3-imidazo[5,1-b][1,3]thiazol-7-ylpyrrolidin-1-yl]-(5-methyl-1,2-oxazol-3-yl)methanone?
[(3R)-3-imidazo[5,1-b][1,3]thiazol-7-ylpyrrolidin-1-yl]-(5-methyl-1,2-oxazol-3-yl)methanone has a molecular weight of 302.36 g/mol, XLogP of 2.32, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [(3R)-3-imidazo[5,1-b][1,3]thiazol-7-ylpyrrolidin-1-yl]-(5-methyl-1,2-oxazol-3-yl)methanone is sourced from PubChem (CID 124984909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).