6-[(4-fluoropiperidin-4-yl)methyl]imidazo[2,1-b][1,3]thiazole

C11H14FN3S — CID 112563287

IUPAC6-[(4-fluoropiperidin-4-yl)methyl]imidazo[2,1-b][1,3]thiazole
SMILESFC1(Cc2cn3ccsc3n2)CCNCC1
InChIInChI=1S/C11H14FN3S/c12-11(1-3-13-4-2-11)7-9-8-15-5-6-16-10(15)14-9/h5-6,8,13H,1-4,7H2
InChIKeyIQBORADHMHFPTM-UHFFFAOYSA-N
MW239.32 g/mol
LogP2.03
Rot. Bonds2

About 6-[(4-fluoropiperidin-4-yl)methyl]imidazo[2,1-b][1,3]thiazole

6-[(4-fluoropiperidin-4-yl)methyl]imidazo[2,1-b][1,3]thiazole (PubChem CID 112563287) has the molecular formula C11H14FN3S and a molecular weight of 239.32 g/mol. Its IUPAC name is 6-[(4-fluoropiperidin-4-yl)methyl]imidazo[2,1-b][1,3]thiazole.

Molecular Properties

Compound Name6-[(4-fluoropiperidin-4-yl)methyl]imidazo[2,1-b][1,3]thiazole
PubChem CID112563287
Molecular FormulaC11H14FN3S
Molecular Weight239.32 g/mol
Exact Mass239.09
IUPAC Name6-[(4-fluoropiperidin-4-yl)methyl]imidazo[2,1-b][1,3]thiazole
SMILESFC1(Cc2cn3ccsc3n2)CCNCC1
InChIInChI=1S/C11H14FN3S/c12-11(1-3-13-4-2-11)7-9-8-15-5-6-16-10(15)14-9/h5-6,8,13H,1-4,7H2
InChIKeyIQBORADHMHFPTM-UHFFFAOYSA-N
XLogP2.03
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-[(4-fluoropiperidin-4-yl)methyl]imidazo[2,1-b][1,3]thiazole?
The IUPAC name of 6-[(4-fluoropiperidin-4-yl)methyl]imidazo[2,1-b][1,3]thiazole (CID 112563287) is 6-[(4-fluoropiperidin-4-yl)methyl]imidazo[2,1-b][1,3]thiazole.
What is the SMILES notation for 6-[(4-fluoropiperidin-4-yl)methyl]imidazo[2,1-b][1,3]thiazole?
The canonical SMILES for 6-[(4-fluoropiperidin-4-yl)methyl]imidazo[2,1-b][1,3]thiazole is FC1(Cc2cn3ccsc3n2)CCNCC1.
What is the InChIKey of 6-[(4-fluoropiperidin-4-yl)methyl]imidazo[2,1-b][1,3]thiazole?
The InChIKey is IQBORADHMHFPTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14FN3S/c12-11(1-3-13-4-2-11)7-9-8-15-5-6-16-10(15)14-9/h5-6,8,13H,1-4,7H2.
What are the key properties of 6-[(4-fluoropiperidin-4-yl)methyl]imidazo[2,1-b][1,3]thiazole?
6-[(4-fluoropiperidin-4-yl)methyl]imidazo[2,1-b][1,3]thiazole has a molecular weight of 239.32 g/mol, XLogP of 2.03, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(4-fluoropiperidin-4-yl)methyl]imidazo[2,1-b][1,3]thiazole is sourced from PubChem (CID 112563287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).