4-(2,5-difluorophenyl)-5-methyl-2-pyrrolidin-2-yl-1,3-thiazole

C14H14F2N2S — CID 102554205

IUPAC4-(2,5-difluorophenyl)-5-methyl-2-pyrrolidin-2-yl-1,3-thiazole
SMILESCc1sc(C2CCCN2)nc1-c1cc(F)ccc1F
InChIInChI=1S/C14H14F2N2S/c1-8-13(10-7-9(15)4-5-11(10)16)18-14(19-8)12-3-2-6-17-12/h4-5,7,12,17H,2-3,6H2,1H3
InChIKeyPALMWRXWPLTSNV-UHFFFAOYSA-N
MW280.34 g/mol
LogP3.82
Rot. Bonds2

About 4-(2,5-difluorophenyl)-5-methyl-2-pyrrolidin-2-yl-1,3-thiazole

4-(2,5-difluorophenyl)-5-methyl-2-pyrrolidin-2-yl-1,3-thiazole (PubChem CID 102554205) has the molecular formula C14H14F2N2S and a molecular weight of 280.34 g/mol. Its IUPAC name is 4-(2,5-difluorophenyl)-5-methyl-2-pyrrolidin-2-yl-1,3-thiazole.

Molecular Properties

Compound Name4-(2,5-difluorophenyl)-5-methyl-2-pyrrolidin-2-yl-1,3-thiazole
PubChem CID102554205
Molecular FormulaC14H14F2N2S
Molecular Weight280.34 g/mol
Exact Mass280.08
IUPAC Name4-(2,5-difluorophenyl)-5-methyl-2-pyrrolidin-2-yl-1,3-thiazole
SMILESCc1sc(C2CCCN2)nc1-c1cc(F)ccc1F
InChIInChI=1S/C14H14F2N2S/c1-8-13(10-7-9(15)4-5-11(10)16)18-14(19-8)12-3-2-6-17-12/h4-5,7,12,17H,2-3,6H2,1H3
InChIKeyPALMWRXWPLTSNV-UHFFFAOYSA-N
XLogP3.82
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.34
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-(2,5-difluorophenyl)-5-methyl-2-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-(4-chlorophenyl)-5-methyl-2-pyrrolidin-2-yl-1,3-thiazole
CID 62542301
5-methyl-4-(4-methylphenyl)-2-piperidin-2-yl-1,3-thiazole
CID 55084812
4-bromo-3-(2,5-difluorophenyl)-5-pyrrolidin-2-yl-1H-pyrazole
CID 84608392
2-(5-fluoro-2-methylphenyl)-4-[(2S)-pyrrolidin-2-yl]-1,3-thiazole
CID 104928656
(2S)-2-(2,5-difluorophenyl)pyrrolidine
CID 7176288
CID 174947937
CID 174947937
1-[4-(2,5-difluorophenyl)-5-methyl-1,3-thiazol-2-yl]ethanol
CID 116867625
3-[4-(5-fluoro-2-pyridinyl)-5-methyl-1,3-thiazol-2-yl]morpholine
CID 102748349
4-fluoro-2-[(2R)-pyrrolidin-2-yl]pyridine
CID 130713831
4-fluoro-2-pyrrolidin-2-ylphenol
CID 55283497
(2R)-2-(2-fluoro-5-methylphenyl)pyrrolidine;hydrochloride
CID 66518747
2-pyrrolidin-2-yl-4,5-dihydrobenzo[e][1,3]benzothiazole
CID 62541233

Frequently Asked Questions

What is the IUPAC name of 4-(2,5-difluorophenyl)-5-methyl-2-pyrrolidin-2-yl-1,3-thiazole?
The IUPAC name of 4-(2,5-difluorophenyl)-5-methyl-2-pyrrolidin-2-yl-1,3-thiazole (CID 102554205) is 4-(2,5-difluorophenyl)-5-methyl-2-pyrrolidin-2-yl-1,3-thiazole.
What is the SMILES notation for 4-(2,5-difluorophenyl)-5-methyl-2-pyrrolidin-2-yl-1,3-thiazole?
The canonical SMILES for 4-(2,5-difluorophenyl)-5-methyl-2-pyrrolidin-2-yl-1,3-thiazole is Cc1sc(C2CCCN2)nc1-c1cc(F)ccc1F.
What is the InChIKey of 4-(2,5-difluorophenyl)-5-methyl-2-pyrrolidin-2-yl-1,3-thiazole?
The InChIKey is PALMWRXWPLTSNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14F2N2S/c1-8-13(10-7-9(15)4-5-11(10)16)18-14(19-8)12-3-2-6-17-12/h4-5,7,12,17H,2-3,6H2,1H3.
What are the key properties of 4-(2,5-difluorophenyl)-5-methyl-2-pyrrolidin-2-yl-1,3-thiazole?
4-(2,5-difluorophenyl)-5-methyl-2-pyrrolidin-2-yl-1,3-thiazole has a molecular weight of 280.34 g/mol, XLogP of 3.82, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,5-difluorophenyl)-5-methyl-2-pyrrolidin-2-yl-1,3-thiazole is sourced from PubChem (CID 102554205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).