N-phenyl-3-(1,3-thiazol-2-yloxy)azetidine-1-carboxamide

C13H13N3O2S — CID 90627669

IUPACN-phenyl-3-(1,3-thiazol-2-yloxy)azetidine-1-carboxamide
SMILESO=C(Nc1ccccc1)N1CC(Oc2nccs2)C1
InChIInChI=1S/C13H13N3O2S/c17-12(15-10-4-2-1-3-5-10)16-8-11(9-16)18-13-14-6-7-19-13/h1-7,11H,8-9H2,(H,15,17)
InChIKeyLIVMNAJHPJWDAQ-UHFFFAOYSA-N
MW275.33 g/mol
LogP2.44
Rot. Bonds3

About N-phenyl-3-(1,3-thiazol-2-yloxy)azetidine-1-carboxamide

N-phenyl-3-(1,3-thiazol-2-yloxy)azetidine-1-carboxamide (PubChem CID 90627669) has the molecular formula C13H13N3O2S and a molecular weight of 275.33 g/mol. Its IUPAC name is N-phenyl-3-(1,3-thiazol-2-yloxy)azetidine-1-carboxamide.

Molecular Properties

Compound NameN-phenyl-3-(1,3-thiazol-2-yloxy)azetidine-1-carboxamide
PubChem CID90627669
Molecular FormulaC13H13N3O2S
Molecular Weight275.33 g/mol
Exact Mass275.07
IUPAC NameN-phenyl-3-(1,3-thiazol-2-yloxy)azetidine-1-carboxamide
SMILESO=C(Nc1ccccc1)N1CC(Oc2nccs2)C1
InChIInChI=1S/C13H13N3O2S/c17-12(15-10-4-2-1-3-5-10)16-8-11(9-16)18-13-14-6-7-19-13/h1-7,11H,8-9H2,(H,15,17)
InChIKeyLIVMNAJHPJWDAQ-UHFFFAOYSA-N
XLogP2.44
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.33
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-phenyl-3-(1,3-thiazol-2-yloxy)azetidine-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-phenyl-3-(1,3-thiazol-2-yloxy)azetidine-1-carboxamide?
The IUPAC name of N-phenyl-3-(1,3-thiazol-2-yloxy)azetidine-1-carboxamide (CID 90627669) is N-phenyl-3-(1,3-thiazol-2-yloxy)azetidine-1-carboxamide.
What is the SMILES notation for N-phenyl-3-(1,3-thiazol-2-yloxy)azetidine-1-carboxamide?
The canonical SMILES for N-phenyl-3-(1,3-thiazol-2-yloxy)azetidine-1-carboxamide is O=C(Nc1ccccc1)N1CC(Oc2nccs2)C1.
What is the InChIKey of N-phenyl-3-(1,3-thiazol-2-yloxy)azetidine-1-carboxamide?
The InChIKey is LIVMNAJHPJWDAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N3O2S/c17-12(15-10-4-2-1-3-5-10)16-8-11(9-16)18-13-14-6-7-19-13/h1-7,11H,8-9H2,(H,15,17).
What are the key properties of N-phenyl-3-(1,3-thiazol-2-yloxy)azetidine-1-carboxamide?
N-phenyl-3-(1,3-thiazol-2-yloxy)azetidine-1-carboxamide has a molecular weight of 275.33 g/mol, XLogP of 2.44, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-3-(1,3-thiazol-2-yloxy)azetidine-1-carboxamide is sourced from PubChem (CID 90627669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).