5-[1-[2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)acetyl]piperidin-4-yl]-5-ethylimidazolidine-2,4-dione

C17H23N5O3S — CID 56740245

IUPAC5-[1-[2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)acetyl]piperidin-4-yl]-5-ethylimidazolidine-2,4-dione
SMILESCCC1(C2CCN(C(=O)CC3=CSC4=NCCN34)CC2)NC(=O)NC1=O
InChIInChI=1S/C17H23N5O3S/c1-2-17(14(24)19-15(25)20-17)11-3-6-21(7-4-11)13(23)9-12-10-26-16-18-5-8-22(12)16/h10-11H,2-9H2,1H3,(H2,19,20,24,25)
InChIKeyHJFUJILMGKTQLH-UHFFFAOYSA-N
MW377.47 g/mol
LogP0.86
Rot. Bonds4

About 5-[1-[2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)acetyl]piperidin-4-yl]-5-ethylimidazolidine-2,4-dione

5-[1-[2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)acetyl]piperidin-4-yl]-5-ethylimidazolidine-2,4-dione (PubChem CID 56740245) has the molecular formula C17H23N5O3S and a molecular weight of 377.47 g/mol. Its IUPAC name is 5-[1-[2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)acetyl]piperidin-4-yl]-5-ethylimidazolidine-2,4-dione.

Molecular Properties

Compound Name5-[1-[2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)acetyl]piperidin-4-yl]-5-ethylimidazolidine-2,4-dione
PubChem CID56740245
Molecular FormulaC17H23N5O3S
Molecular Weight377.47 g/mol
Exact Mass377.15
IUPAC Name5-[1-[2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)acetyl]piperidin-4-yl]-5-ethylimidazolidine-2,4-dione
SMILESCCC1(C2CCN(C(=O)CC3=CSC4=NCCN34)CC2)NC(=O)NC1=O
InChIInChI=1S/C17H23N5O3S/c1-2-17(14(24)19-15(25)20-17)11-3-6-21(7-4-11)13(23)9-12-10-26-16-18-5-8-22(12)16/h10-11H,2-9H2,1H3,(H2,19,20,24,25)
InChIKeyHJFUJILMGKTQLH-UHFFFAOYSA-N
XLogP0.86
TPSA94.11 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.47
LogP ≤ 50.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-[1-[2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)acetyl]piperidin-4-yl]-5-ethylimidazolidine-2,4-dione?
The IUPAC name of 5-[1-[2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)acetyl]piperidin-4-yl]-5-ethylimidazolidine-2,4-dione (CID 56740245) is 5-[1-[2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)acetyl]piperidin-4-yl]-5-ethylimidazolidine-2,4-dione.
What is the SMILES notation for 5-[1-[2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)acetyl]piperidin-4-yl]-5-ethylimidazolidine-2,4-dione?
The canonical SMILES for 5-[1-[2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)acetyl]piperidin-4-yl]-5-ethylimidazolidine-2,4-dione is CCC1(C2CCN(C(=O)CC3=CSC4=NCCN34)CC2)NC(=O)NC1=O.
What is the InChIKey of 5-[1-[2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)acetyl]piperidin-4-yl]-5-ethylimidazolidine-2,4-dione?
The InChIKey is HJFUJILMGKTQLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N5O3S/c1-2-17(14(24)19-15(25)20-17)11-3-6-21(7-4-11)13(23)9-12-10-26-16-18-5-8-22(12)16/h10-11H,2-9H2,1H3,(H2,19,20,24,25).
What are the key properties of 5-[1-[2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)acetyl]piperidin-4-yl]-5-ethylimidazolidine-2,4-dione?
5-[1-[2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)acetyl]piperidin-4-yl]-5-ethylimidazolidine-2,4-dione has a molecular weight of 377.47 g/mol, XLogP of 0.86, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[1-[2-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-yl)acetyl]piperidin-4-yl]-5-ethylimidazolidine-2,4-dione is sourced from PubChem (CID 56740245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).