[4-(5-methylimidazo[5,1-b][1,3]thiazol-7-yl)piperidin-1-yl]-(1,3-thiazol-4-yl)methanone

C15H16N4OS2 — CID 92564314

IUPAC[4-(5-methylimidazo[5,1-b][1,3]thiazol-7-yl)piperidin-1-yl]-(1,3-thiazol-4-yl)methanone
SMILESCc1nc(C2CCN(C(=O)c3cscn3)CC2)c2sccn12
InChIInChI=1S/C15H16N4OS2/c1-10-17-13(15-19(10)6-7-22-15)11-2-4-18(5-3-11)14(20)12-8-21-9-16-12/h6-9,11H,2-5H2,1H3
InChIKeyWQEDITSBGAHFCY-UHFFFAOYSA-N
MW332.45 g/mol
LogP3.18
Rot. Bonds2

About [4-(5-methylimidazo[5,1-b][1,3]thiazol-7-yl)piperidin-1-yl]-(1,3-thiazol-4-yl)methanone

[4-(5-methylimidazo[5,1-b][1,3]thiazol-7-yl)piperidin-1-yl]-(1,3-thiazol-4-yl)methanone (PubChem CID 92564314) has the molecular formula C15H16N4OS2 and a molecular weight of 332.45 g/mol. Its IUPAC name is [4-(5-methylimidazo[5,1-b][1,3]thiazol-7-yl)piperidin-1-yl]-(1,3-thiazol-4-yl)methanone.

Molecular Properties

Compound Name[4-(5-methylimidazo[5,1-b][1,3]thiazol-7-yl)piperidin-1-yl]-(1,3-thiazol-4-yl)methanone
PubChem CID92564314
Molecular FormulaC15H16N4OS2
Molecular Weight332.45 g/mol
Exact Mass332.08
IUPAC Name[4-(5-methylimidazo[5,1-b][1,3]thiazol-7-yl)piperidin-1-yl]-(1,3-thiazol-4-yl)methanone
SMILESCc1nc(C2CCN(C(=O)c3cscn3)CC2)c2sccn12
InChIInChI=1S/C15H16N4OS2/c1-10-17-13(15-19(10)6-7-22-15)11-2-4-18(5-3-11)14(20)12-8-21-9-16-12/h6-9,11H,2-5H2,1H3
InChIKeyWQEDITSBGAHFCY-UHFFFAOYSA-N
XLogP3.18
TPSA50.50 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.45
LogP ≤ 53.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of [4-(5-methylimidazo[5,1-b][1,3]thiazol-7-yl)piperidin-1-yl]-(1,3-thiazol-4-yl)methanone?
The IUPAC name of [4-(5-methylimidazo[5,1-b][1,3]thiazol-7-yl)piperidin-1-yl]-(1,3-thiazol-4-yl)methanone (CID 92564314) is [4-(5-methylimidazo[5,1-b][1,3]thiazol-7-yl)piperidin-1-yl]-(1,3-thiazol-4-yl)methanone.
What is the SMILES notation for [4-(5-methylimidazo[5,1-b][1,3]thiazol-7-yl)piperidin-1-yl]-(1,3-thiazol-4-yl)methanone?
The canonical SMILES for [4-(5-methylimidazo[5,1-b][1,3]thiazol-7-yl)piperidin-1-yl]-(1,3-thiazol-4-yl)methanone is Cc1nc(C2CCN(C(=O)c3cscn3)CC2)c2sccn12.
What is the InChIKey of [4-(5-methylimidazo[5,1-b][1,3]thiazol-7-yl)piperidin-1-yl]-(1,3-thiazol-4-yl)methanone?
The InChIKey is WQEDITSBGAHFCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4OS2/c1-10-17-13(15-19(10)6-7-22-15)11-2-4-18(5-3-11)14(20)12-8-21-9-16-12/h6-9,11H,2-5H2,1H3.
What are the key properties of [4-(5-methylimidazo[5,1-b][1,3]thiazol-7-yl)piperidin-1-yl]-(1,3-thiazol-4-yl)methanone?
[4-(5-methylimidazo[5,1-b][1,3]thiazol-7-yl)piperidin-1-yl]-(1,3-thiazol-4-yl)methanone has a molecular weight of 332.45 g/mol, XLogP of 3.18, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(5-methylimidazo[5,1-b][1,3]thiazol-7-yl)piperidin-1-yl]-(1,3-thiazol-4-yl)methanone is sourced from PubChem (CID 92564314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).