4-(2-fluoropropan-2-yl)-2-pyrrolidin-3-yl-1,3-thiazole

C10H15FN2S — CID 84783502

IUPAC4-(2-fluoropropan-2-yl)-2-pyrrolidin-3-yl-1,3-thiazole
SMILESCC(C)(F)c1csc(C2CCNC2)n1
InChIInChI=1S/C10H15FN2S/c1-10(2,11)8-6-14-9(13-8)7-3-4-12-5-7/h6-7,12H,3-5H2,1-2H3
InChIKeyRITXJJUDUDNWOS-UHFFFAOYSA-N
MW214.31 g/mol
LogP2.42
Rot. Bonds2

About 4-(2-fluoropropan-2-yl)-2-pyrrolidin-3-yl-1,3-thiazole

4-(2-fluoropropan-2-yl)-2-pyrrolidin-3-yl-1,3-thiazole (PubChem CID 84783502) has the molecular formula C10H15FN2S and a molecular weight of 214.31 g/mol. Its IUPAC name is 4-(2-fluoropropan-2-yl)-2-pyrrolidin-3-yl-1,3-thiazole.

Molecular Properties

Compound Name4-(2-fluoropropan-2-yl)-2-pyrrolidin-3-yl-1,3-thiazole
PubChem CID84783502
Molecular FormulaC10H15FN2S
Molecular Weight214.31 g/mol
Exact Mass214.09
IUPAC Name4-(2-fluoropropan-2-yl)-2-pyrrolidin-3-yl-1,3-thiazole
SMILESCC(C)(F)c1csc(C2CCNC2)n1
InChIInChI=1S/C10H15FN2S/c1-10(2,11)8-6-14-9(13-8)7-3-4-12-5-7/h6-7,12H,3-5H2,1-2H3
InChIKeyRITXJJUDUDNWOS-UHFFFAOYSA-N
XLogP2.42
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-(2-fluoropropan-2-yl)-2-pyrrolidin-3-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

Frequently Asked Questions

What is the IUPAC name of 4-(2-fluoropropan-2-yl)-2-pyrrolidin-3-yl-1,3-thiazole?
The IUPAC name of 4-(2-fluoropropan-2-yl)-2-pyrrolidin-3-yl-1,3-thiazole (CID 84783502) is 4-(2-fluoropropan-2-yl)-2-pyrrolidin-3-yl-1,3-thiazole.
What is the SMILES notation for 4-(2-fluoropropan-2-yl)-2-pyrrolidin-3-yl-1,3-thiazole?
The canonical SMILES for 4-(2-fluoropropan-2-yl)-2-pyrrolidin-3-yl-1,3-thiazole is CC(C)(F)c1csc(C2CCNC2)n1.
What is the InChIKey of 4-(2-fluoropropan-2-yl)-2-pyrrolidin-3-yl-1,3-thiazole?
The InChIKey is RITXJJUDUDNWOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15FN2S/c1-10(2,11)8-6-14-9(13-8)7-3-4-12-5-7/h6-7,12H,3-5H2,1-2H3.
What are the key properties of 4-(2-fluoropropan-2-yl)-2-pyrrolidin-3-yl-1,3-thiazole?
4-(2-fluoropropan-2-yl)-2-pyrrolidin-3-yl-1,3-thiazole has a molecular weight of 214.31 g/mol, XLogP of 2.42, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-fluoropropan-2-yl)-2-pyrrolidin-3-yl-1,3-thiazole is sourced from PubChem (CID 84783502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).