2-(2-fluorophenyl)-4-piperidin-4-yl-1,3-thiazole

C14H15FN2S — CID 116888734

IUPAC2-(2-fluorophenyl)-4-piperidin-4-yl-1,3-thiazole
SMILESFc1ccccc1-c1nc(C2CCNCC2)cs1
InChIInChI=1S/C14H15FN2S/c15-12-4-2-1-3-11(12)14-17-13(9-18-14)10-5-7-16-8-6-10/h1-4,9-10,16H,5-8H2
InChIKeyGJBBOAUSVZZQDB-UHFFFAOYSA-N
MW262.35 g/mol
LogP3.42
Rot. Bonds2

About 2-(2-fluorophenyl)-4-piperidin-4-yl-1,3-thiazole

2-(2-fluorophenyl)-4-piperidin-4-yl-1,3-thiazole (PubChem CID 116888734) has the molecular formula C14H15FN2S and a molecular weight of 262.35 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-4-piperidin-4-yl-1,3-thiazole.

Molecular Properties

Compound Name2-(2-fluorophenyl)-4-piperidin-4-yl-1,3-thiazole
PubChem CID116888734
Molecular FormulaC14H15FN2S
Molecular Weight262.35 g/mol
Exact Mass262.09
IUPAC Name2-(2-fluorophenyl)-4-piperidin-4-yl-1,3-thiazole
SMILESFc1ccccc1-c1nc(C2CCNCC2)cs1
InChIInChI=1S/C14H15FN2S/c15-12-4-2-1-3-11(12)14-17-13(9-18-14)10-5-7-16-8-6-10/h1-4,9-10,16H,5-8H2
InChIKeyGJBBOAUSVZZQDB-UHFFFAOYSA-N
XLogP3.42
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenyl)-4-piperidin-4-yl-1,3-thiazole?
The IUPAC name of 2-(2-fluorophenyl)-4-piperidin-4-yl-1,3-thiazole (CID 116888734) is 2-(2-fluorophenyl)-4-piperidin-4-yl-1,3-thiazole.
What is the SMILES notation for 2-(2-fluorophenyl)-4-piperidin-4-yl-1,3-thiazole?
The canonical SMILES for 2-(2-fluorophenyl)-4-piperidin-4-yl-1,3-thiazole is Fc1ccccc1-c1nc(C2CCNCC2)cs1.
What is the InChIKey of 2-(2-fluorophenyl)-4-piperidin-4-yl-1,3-thiazole?
The InChIKey is GJBBOAUSVZZQDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15FN2S/c15-12-4-2-1-3-11(12)14-17-13(9-18-14)10-5-7-16-8-6-10/h1-4,9-10,16H,5-8H2.
What are the key properties of 2-(2-fluorophenyl)-4-piperidin-4-yl-1,3-thiazole?
2-(2-fluorophenyl)-4-piperidin-4-yl-1,3-thiazole has a molecular weight of 262.35 g/mol, XLogP of 3.42, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)-4-piperidin-4-yl-1,3-thiazole is sourced from PubChem (CID 116888734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).