2-(furan-3-yl)-4-[(2S)-pyrrolidin-2-yl]-1,3-thiazole

C11H12N2OS — CID 104853434

IUPAC2-(furan-3-yl)-4-[(2S)-pyrrolidin-2-yl]-1,3-thiazole
SMILESc1cc(-c2nc([C@@H]3CCCN3)cs2)co1
InChIInChI=1S/C11H12N2OS/c1-2-9(12-4-1)10-7-15-11(13-10)8-3-5-14-6-8/h3,5-7,9,12H,1-2,4H2/t9-/m0/s1
InChIKeyAGUDGZPGUABEDU-VIFPVBQESA-N
MW220.30 g/mol
LogP2.83
Rot. Bonds2

About 2-(furan-3-yl)-4-[(2S)-pyrrolidin-2-yl]-1,3-thiazole

2-(furan-3-yl)-4-[(2S)-pyrrolidin-2-yl]-1,3-thiazole (PubChem CID 104853434) has the molecular formula C11H12N2OS and a molecular weight of 220.30 g/mol. Its IUPAC name is 2-(furan-3-yl)-4-[(2S)-pyrrolidin-2-yl]-1,3-thiazole.

Molecular Properties

Compound Name2-(furan-3-yl)-4-[(2S)-pyrrolidin-2-yl]-1,3-thiazole
PubChem CID104853434
Molecular FormulaC11H12N2OS
Molecular Weight220.30 g/mol
Exact Mass220.07
IUPAC Name2-(furan-3-yl)-4-[(2S)-pyrrolidin-2-yl]-1,3-thiazole
SMILESc1cc(-c2nc([C@@H]3CCCN3)cs2)co1
InChIInChI=1S/C11H12N2OS/c1-2-9(12-4-1)10-7-15-11(13-10)8-3-5-14-6-8/h3,5-7,9,12H,1-2,4H2/t9-/m0/s1
InChIKeyAGUDGZPGUABEDU-VIFPVBQESA-N
XLogP2.83
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.30
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(furan-3-yl)-4-[(2S)-pyrrolidin-2-yl]-1,3-thiazole 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-[(2S)-pyrrolidin-2-yl]-2-thiophen-3-yl-1,3-thiazole
CID 104853421
2-(furan-3-yl)-4-(oxan-4-yl)-1,3-thiazole
CID 84593643
2-(1-methylpyrazol-3-yl)-4-[(2S)-pyrrolidin-2-yl]-1,3-thiazole
CID 104928825
2-(4-bromo-3,5-dimethylphenyl)-4-pyrrolidin-2-yl-1,3-thiazole
CID 114456862
2-(2-bromophenyl)-4-[(2S)-pyrrolidin-2-yl]-1,3-thiazole
CID 104928821
2-(furan-3-yl)-N-(pyrrolidin-2-ylmethyl)-1,3-thiazole-4-carboxamide
CID 119514774
2-(4,6-dimethyl-2-pyridinyl)-4-pyrrolidin-2-yl-1,3-thiazole
CID 114269459
2-(3-bromo-4-methoxyphenyl)-4-pyrrolidin-2-yl-1,3-thiazole
CID 106951192
3-(furan-3-yl)-5-[(2S)-piperidin-2-yl]-1,2,4-oxadiazole
CID 104914944
4-[4-[(2R)-piperidin-2-yl]-1,3-thiazol-2-yl]benzamide
CID 67358308
2-(4-chloro-2-fluorophenyl)-4-pyrrolidin-2-yl-1,3-thiazole
CID 114456904
2-(2-methoxyphenyl)-4-[(2S)-pyrrolidin-2-yl]-1,3-thiazole
CID 104928786

Frequently Asked Questions

What is the IUPAC name of 2-(furan-3-yl)-4-[(2S)-pyrrolidin-2-yl]-1,3-thiazole?
The IUPAC name of 2-(furan-3-yl)-4-[(2S)-pyrrolidin-2-yl]-1,3-thiazole (CID 104853434) is 2-(furan-3-yl)-4-[(2S)-pyrrolidin-2-yl]-1,3-thiazole.
What is the SMILES notation for 2-(furan-3-yl)-4-[(2S)-pyrrolidin-2-yl]-1,3-thiazole?
The canonical SMILES for 2-(furan-3-yl)-4-[(2S)-pyrrolidin-2-yl]-1,3-thiazole is c1cc(-c2nc([C@@H]3CCCN3)cs2)co1.
What is the InChIKey of 2-(furan-3-yl)-4-[(2S)-pyrrolidin-2-yl]-1,3-thiazole?
The InChIKey is AGUDGZPGUABEDU-VIFPVBQESA-N. The full InChI is InChI=1S/C11H12N2OS/c1-2-9(12-4-1)10-7-15-11(13-10)8-3-5-14-6-8/h3,5-7,9,12H,1-2,4H2/t9-/m0/s1.
What are the key properties of 2-(furan-3-yl)-4-[(2S)-pyrrolidin-2-yl]-1,3-thiazole?
2-(furan-3-yl)-4-[(2S)-pyrrolidin-2-yl]-1,3-thiazole has a molecular weight of 220.30 g/mol, XLogP of 2.83, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-3-yl)-4-[(2S)-pyrrolidin-2-yl]-1,3-thiazole is sourced from PubChem (CID 104853434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).