3-cyclobutyl-4-(1,3-thiazol-4-yl)azetidin-2-one

C10H12N2OS — CID 131138402

IUPAC3-cyclobutyl-4-(1,3-thiazol-4-yl)azetidin-2-one
SMILESO=C1NC(c2cscn2)C1C1CCC1
InChIInChI=1S/C10H12N2OS/c13-10-8(6-2-1-3-6)9(12-10)7-4-14-5-11-7/h4-6,8-9H,1-3H2,(H,12,13)
InChIKeyGEZGOSCKFSCMHK-UHFFFAOYSA-N
MW208.29 g/mol
LogP1.73
Rot. Bonds2

About 3-cyclobutyl-4-(1,3-thiazol-4-yl)azetidin-2-one

3-cyclobutyl-4-(1,3-thiazol-4-yl)azetidin-2-one (PubChem CID 131138402) has the molecular formula C10H12N2OS and a molecular weight of 208.29 g/mol. Its IUPAC name is 3-cyclobutyl-4-(1,3-thiazol-4-yl)azetidin-2-one.

Molecular Properties

Compound Name3-cyclobutyl-4-(1,3-thiazol-4-yl)azetidin-2-one
PubChem CID131138402
Molecular FormulaC10H12N2OS
Molecular Weight208.29 g/mol
Exact Mass208.07
IUPAC Name3-cyclobutyl-4-(1,3-thiazol-4-yl)azetidin-2-one
SMILESO=C1NC(c2cscn2)C1C1CCC1
InChIInChI=1S/C10H12N2OS/c13-10-8(6-2-1-3-6)9(12-10)7-4-14-5-11-7/h4-6,8-9H,1-3H2,(H,12,13)
InChIKeyGEZGOSCKFSCMHK-UHFFFAOYSA-N
XLogP1.73
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.29
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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3-cyclopropyl-4-(5-methyl-1,3-thiazol-2-yl)azetidin-2-one
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Frequently Asked Questions

What is the IUPAC name of 3-cyclobutyl-4-(1,3-thiazol-4-yl)azetidin-2-one?
The IUPAC name of 3-cyclobutyl-4-(1,3-thiazol-4-yl)azetidin-2-one (CID 131138402) is 3-cyclobutyl-4-(1,3-thiazol-4-yl)azetidin-2-one.
What is the SMILES notation for 3-cyclobutyl-4-(1,3-thiazol-4-yl)azetidin-2-one?
The canonical SMILES for 3-cyclobutyl-4-(1,3-thiazol-4-yl)azetidin-2-one is O=C1NC(c2cscn2)C1C1CCC1.
What is the InChIKey of 3-cyclobutyl-4-(1,3-thiazol-4-yl)azetidin-2-one?
The InChIKey is GEZGOSCKFSCMHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2OS/c13-10-8(6-2-1-3-6)9(12-10)7-4-14-5-11-7/h4-6,8-9H,1-3H2,(H,12,13).
What are the key properties of 3-cyclobutyl-4-(1,3-thiazol-4-yl)azetidin-2-one?
3-cyclobutyl-4-(1,3-thiazol-4-yl)azetidin-2-one has a molecular weight of 208.29 g/mol, XLogP of 1.73, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclobutyl-4-(1,3-thiazol-4-yl)azetidin-2-one is sourced from PubChem (CID 131138402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).