2-imidazo[2,1-b][1,3]thiazol-6-yl-1-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]ethanone

C16H19N5O2S — CID 51269648

IUPAC2-imidazo[2,1-b][1,3]thiazol-6-yl-1-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]ethanone
SMILESCc1cc(CN2CCN(C(=O)Cc3cn4ccsc4n3)CC2)on1
InChIInChI=1S/C16H19N5O2S/c1-12-8-14(23-18-12)11-19-2-4-20(5-3-19)15(22)9-13-10-21-6-7-24-16(21)17-13/h6-8,10H,2-5,9,11H2,1H3
InChIKeyYVHGVVMGPGDOES-UHFFFAOYSA-N
MW345.43 g/mol
LogP1.58
Rot. Bonds4

About 2-imidazo[2,1-b][1,3]thiazol-6-yl-1-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]ethanone

2-imidazo[2,1-b][1,3]thiazol-6-yl-1-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]ethanone (PubChem CID 51269648) has the molecular formula C16H19N5O2S and a molecular weight of 345.43 g/mol. Its IUPAC name is 2-imidazo[2,1-b][1,3]thiazol-6-yl-1-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]ethanone.

Molecular Properties

Compound Name2-imidazo[2,1-b][1,3]thiazol-6-yl-1-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]ethanone
PubChem CID51269648
Molecular FormulaC16H19N5O2S
Molecular Weight345.43 g/mol
Exact Mass345.13
IUPAC Name2-imidazo[2,1-b][1,3]thiazol-6-yl-1-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]ethanone
SMILESCc1cc(CN2CCN(C(=O)Cc3cn4ccsc4n3)CC2)on1
InChIInChI=1S/C16H19N5O2S/c1-12-8-14(23-18-12)11-19-2-4-20(5-3-19)15(22)9-13-10-21-6-7-24-16(21)17-13/h6-8,10H,2-5,9,11H2,1H3
InChIKeyYVHGVVMGPGDOES-UHFFFAOYSA-N
XLogP1.58
TPSA66.88 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.43
LogP ≤ 51.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-imidazo[2,1-b][1,3]thiazol-6-yl-1-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]ethanone?
The IUPAC name of 2-imidazo[2,1-b][1,3]thiazol-6-yl-1-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]ethanone (CID 51269648) is 2-imidazo[2,1-b][1,3]thiazol-6-yl-1-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]ethanone.
What is the SMILES notation for 2-imidazo[2,1-b][1,3]thiazol-6-yl-1-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]ethanone?
The canonical SMILES for 2-imidazo[2,1-b][1,3]thiazol-6-yl-1-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]ethanone is Cc1cc(CN2CCN(C(=O)Cc3cn4ccsc4n3)CC2)on1.
What is the InChIKey of 2-imidazo[2,1-b][1,3]thiazol-6-yl-1-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]ethanone?
The InChIKey is YVHGVVMGPGDOES-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N5O2S/c1-12-8-14(23-18-12)11-19-2-4-20(5-3-19)15(22)9-13-10-21-6-7-24-16(21)17-13/h6-8,10H,2-5,9,11H2,1H3.
What are the key properties of 2-imidazo[2,1-b][1,3]thiazol-6-yl-1-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]ethanone?
2-imidazo[2,1-b][1,3]thiazol-6-yl-1-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]ethanone has a molecular weight of 345.43 g/mol, XLogP of 1.58, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-imidazo[2,1-b][1,3]thiazol-6-yl-1-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]ethanone is sourced from PubChem (CID 51269648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).