[3-(3,5-dimethylpyrazol-1-yl)azetidin-1-yl]-imidazo[2,1-b][1,3]thiazol-6-ylmethanone

C14H15N5OS — CID 50953495

IUPAC[3-(3,5-dimethylpyrazol-1-yl)azetidin-1-yl]-imidazo[2,1-b][1,3]thiazol-6-ylmethanone
SMILESCc1cc(C)n(C2CN(C(=O)c3cn4ccsc4n3)C2)n1
InChIInChI=1S/C14H15N5OS/c1-9-5-10(2)19(16-9)11-6-18(7-11)13(20)12-8-17-3-4-21-14(17)15-12/h3-5,8,11H,6-7H2,1-2H3
InChIKeyQQDKTDPFCLFSKB-UHFFFAOYSA-N
MW301.38 g/mol
LogP1.91
Rot. Bonds2

About [3-(3,5-dimethylpyrazol-1-yl)azetidin-1-yl]-imidazo[2,1-b][1,3]thiazol-6-ylmethanone

[3-(3,5-dimethylpyrazol-1-yl)azetidin-1-yl]-imidazo[2,1-b][1,3]thiazol-6-ylmethanone (PubChem CID 50953495) has the molecular formula C14H15N5OS and a molecular weight of 301.38 g/mol. Its IUPAC name is [3-(3,5-dimethylpyrazol-1-yl)azetidin-1-yl]-imidazo[2,1-b][1,3]thiazol-6-ylmethanone.

Molecular Properties

Compound Name[3-(3,5-dimethylpyrazol-1-yl)azetidin-1-yl]-imidazo[2,1-b][1,3]thiazol-6-ylmethanone
PubChem CID50953495
Molecular FormulaC14H15N5OS
Molecular Weight301.38 g/mol
Exact Mass301.10
IUPAC Name[3-(3,5-dimethylpyrazol-1-yl)azetidin-1-yl]-imidazo[2,1-b][1,3]thiazol-6-ylmethanone
SMILESCc1cc(C)n(C2CN(C(=O)c3cn4ccsc4n3)C2)n1
InChIInChI=1S/C14H15N5OS/c1-9-5-10(2)19(16-9)11-6-18(7-11)13(20)12-8-17-3-4-21-14(17)15-12/h3-5,8,11H,6-7H2,1-2H3
InChIKeyQQDKTDPFCLFSKB-UHFFFAOYSA-N
XLogP1.91
TPSA55.43 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.38
LogP ≤ 51.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze [3-(3,5-dimethylpyrazol-1-yl)azetidin-1-yl]-imidazo[2,1-b][1,3]thiazol-6-ylmethanone 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 [3-(3,5-dimethylpyrazol-1-yl)azetidin-1-yl]-imidazo[2,1-b][1,3]thiazol-6-ylmethanone?
The IUPAC name of [3-(3,5-dimethylpyrazol-1-yl)azetidin-1-yl]-imidazo[2,1-b][1,3]thiazol-6-ylmethanone (CID 50953495) is [3-(3,5-dimethylpyrazol-1-yl)azetidin-1-yl]-imidazo[2,1-b][1,3]thiazol-6-ylmethanone.
What is the SMILES notation for [3-(3,5-dimethylpyrazol-1-yl)azetidin-1-yl]-imidazo[2,1-b][1,3]thiazol-6-ylmethanone?
The canonical SMILES for [3-(3,5-dimethylpyrazol-1-yl)azetidin-1-yl]-imidazo[2,1-b][1,3]thiazol-6-ylmethanone is Cc1cc(C)n(C2CN(C(=O)c3cn4ccsc4n3)C2)n1.
What is the InChIKey of [3-(3,5-dimethylpyrazol-1-yl)azetidin-1-yl]-imidazo[2,1-b][1,3]thiazol-6-ylmethanone?
The InChIKey is QQDKTDPFCLFSKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N5OS/c1-9-5-10(2)19(16-9)11-6-18(7-11)13(20)12-8-17-3-4-21-14(17)15-12/h3-5,8,11H,6-7H2,1-2H3.
What are the key properties of [3-(3,5-dimethylpyrazol-1-yl)azetidin-1-yl]-imidazo[2,1-b][1,3]thiazol-6-ylmethanone?
[3-(3,5-dimethylpyrazol-1-yl)azetidin-1-yl]-imidazo[2,1-b][1,3]thiazol-6-ylmethanone has a molecular weight of 301.38 g/mol, XLogP of 1.91, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(3,5-dimethylpyrazol-1-yl)azetidin-1-yl]-imidazo[2,1-b][1,3]thiazol-6-ylmethanone is sourced from PubChem (CID 50953495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).