1-(1,3-thiazol-2-yl)azetidin-2-one

C6H6N2OS — CID 559075

IUPAC1-(1,3-thiazol-2-yl)azetidin-2-one
SMILESO=C1CCN1c1nccs1
InChIInChI=1S/C6H6N2OS/c9-5-1-3-8(5)6-7-2-4-10-6/h2,4H,1,3H2
InChIKeyCCBLADXHKQXMMN-UHFFFAOYSA-N
MW154.19 g/mol
LogP0.88
Rot. Bonds1

About 1-(1,3-thiazol-2-yl)azetidin-2-one

1-(1,3-thiazol-2-yl)azetidin-2-one (PubChem CID 559075) has the molecular formula C6H6N2OS and a molecular weight of 154.19 g/mol. Its IUPAC name is 1-(1,3-thiazol-2-yl)azetidin-2-one.

Molecular Properties

Compound Name1-(1,3-thiazol-2-yl)azetidin-2-one
PubChem CID559075
Molecular FormulaC6H6N2OS
Molecular Weight154.19 g/mol
Exact Mass154.02
IUPAC Name1-(1,3-thiazol-2-yl)azetidin-2-one
SMILESO=C1CCN1c1nccs1
InChIInChI=1S/C6H6N2OS/c9-5-1-3-8(5)6-7-2-4-10-6/h2,4H,1,3H2
InChIKeyCCBLADXHKQXMMN-UHFFFAOYSA-N
XLogP0.88
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.19
LogP ≤ 50.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-cyano-N-(1,3-thiazol-2-yl)acetamide
CID 693166
1-(Thiazol-2-yl)pyrrolidin-2-one
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1-(1,3-Thiazol-2-yl)pyrrolidine-2,5-dione
CID 934529
N-(1,3-Thiazol-2-yl)propanamide
CID 247650
8-Methyl-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-5,7-dione
CID 44459107
Thiazolyl-thiazolidine-2,4-dione
CID 129820905
3-Fluoro-1-(1,3-thiazol-2-yl)pyrrolidin-2-one
CID 175506869
2-(3-Fluoroazetidin-1-yl)-1,3-thiazole
CID 175907303
Thiazol-2-ylthiazolidinone
CID 129761745
1-Thiazole-2-yl-methyl-azetidin-2-one
CID 129860268
2,2,2-trifluoro-N-methyl-N-(1,3-thiazol-2-yl)acetamide
CID 85575649
2-fluoro-N-methyl-N-(1,3-thiazol-2-yl)acetamide
CID 119081750

Frequently Asked Questions

What is the IUPAC name of 1-(1,3-thiazol-2-yl)azetidin-2-one?
The IUPAC name of 1-(1,3-thiazol-2-yl)azetidin-2-one (CID 559075) is 1-(1,3-thiazol-2-yl)azetidin-2-one.
What is the SMILES notation for 1-(1,3-thiazol-2-yl)azetidin-2-one?
The canonical SMILES for 1-(1,3-thiazol-2-yl)azetidin-2-one is O=C1CCN1c1nccs1.
What is the InChIKey of 1-(1,3-thiazol-2-yl)azetidin-2-one?
The InChIKey is CCBLADXHKQXMMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6N2OS/c9-5-1-3-8(5)6-7-2-4-10-6/h2,4H,1,3H2.
What are the key properties of 1-(1,3-thiazol-2-yl)azetidin-2-one?
1-(1,3-thiazol-2-yl)azetidin-2-one has a molecular weight of 154.19 g/mol, XLogP of 0.88, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,3-thiazol-2-yl)azetidin-2-one is sourced from PubChem (CID 559075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).