2-(4-fluorophenyl)-3-methyl-1,3-thiazolidine

C10H12FNS — CID 3024550

IUPAC2-(4-fluorophenyl)-3-methyl-1,3-thiazolidine
SMILESCN1CCSC1c1ccc(F)cc1
InChIInChI=1S/C10H12FNS/c1-12-6-7-13-10(12)8-2-4-9(11)5-3-8/h2-5,10H,6-7H2,1H3
InChIKeyVVWKHNPCHBJUFD-UHFFFAOYSA-N
MW197.28 g/mol
LogP2.50
Rot. Bonds1

About 2-(4-fluorophenyl)-3-methyl-1,3-thiazolidine

2-(4-fluorophenyl)-3-methyl-1,3-thiazolidine (PubChem CID 3024550) has the molecular formula C10H12FNS and a molecular weight of 197.28 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-3-methyl-1,3-thiazolidine.

Molecular Properties

Compound Name2-(4-fluorophenyl)-3-methyl-1,3-thiazolidine
PubChem CID3024550
Molecular FormulaC10H12FNS
Molecular Weight197.28 g/mol
Exact Mass197.07
IUPAC Name2-(4-fluorophenyl)-3-methyl-1,3-thiazolidine
SMILESCN1CCSC1c1ccc(F)cc1
InChIInChI=1S/C10H12FNS/c1-12-6-7-13-10(12)8-2-4-9(11)5-3-8/h2-5,10H,6-7H2,1H3
InChIKeyVVWKHNPCHBJUFD-UHFFFAOYSA-N
XLogP2.50
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 52.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-3-methyl-1,3-thiazolidine?
The IUPAC name of 2-(4-fluorophenyl)-3-methyl-1,3-thiazolidine (CID 3024550) is 2-(4-fluorophenyl)-3-methyl-1,3-thiazolidine.
What is the SMILES notation for 2-(4-fluorophenyl)-3-methyl-1,3-thiazolidine?
The canonical SMILES for 2-(4-fluorophenyl)-3-methyl-1,3-thiazolidine is CN1CCSC1c1ccc(F)cc1.
What is the InChIKey of 2-(4-fluorophenyl)-3-methyl-1,3-thiazolidine?
The InChIKey is VVWKHNPCHBJUFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12FNS/c1-12-6-7-13-10(12)8-2-4-9(11)5-3-8/h2-5,10H,6-7H2,1H3.
What are the key properties of 2-(4-fluorophenyl)-3-methyl-1,3-thiazolidine?
2-(4-fluorophenyl)-3-methyl-1,3-thiazolidine has a molecular weight of 197.28 g/mol, XLogP of 2.50, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-3-methyl-1,3-thiazolidine is sourced from PubChem (CID 3024550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).