[6-(3,5-diethylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine

C13H17N5S — CID 82694813

IUPAC[6-(3,5-diethylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine
SMILESCCc1cc(CC)n(-c2nc3sccn3c2CN)n1
InChIInChI=1S/C13H17N5S/c1-3-9-7-10(4-2)18(16-9)12-11(8-14)17-5-6-19-13(17)15-12/h5-7H,3-4,8,14H2,1-2H3
InChIKeyKQSMKZPMOAMIBK-UHFFFAOYSA-N
MW275.38 g/mol
LogP2.16
Rot. Bonds4

About [6-(3,5-diethylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine

[6-(3,5-diethylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine (PubChem CID 82694813) has the molecular formula C13H17N5S and a molecular weight of 275.38 g/mol. Its IUPAC name is [6-(3,5-diethylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine.

Molecular Properties

Compound Name[6-(3,5-diethylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine
PubChem CID82694813
Molecular FormulaC13H17N5S
Molecular Weight275.38 g/mol
Exact Mass275.12
IUPAC Name[6-(3,5-diethylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine
SMILESCCc1cc(CC)n(-c2nc3sccn3c2CN)n1
InChIInChI=1S/C13H17N5S/c1-3-9-7-10(4-2)18(16-9)12-11(8-14)17-5-6-19-13(17)15-12/h5-7H,3-4,8,14H2,1-2H3
InChIKeyKQSMKZPMOAMIBK-UHFFFAOYSA-N
XLogP2.16
TPSA61.14 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.38
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze [6-(3,5-diethylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine 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 [6-(3,5-diethylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine?
The IUPAC name of [6-(3,5-diethylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine (CID 82694813) is [6-(3,5-diethylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine.
What is the SMILES notation for [6-(3,5-diethylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine?
The canonical SMILES for [6-(3,5-diethylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine is CCc1cc(CC)n(-c2nc3sccn3c2CN)n1.
What is the InChIKey of [6-(3,5-diethylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine?
The InChIKey is KQSMKZPMOAMIBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N5S/c1-3-9-7-10(4-2)18(16-9)12-11(8-14)17-5-6-19-13(17)15-12/h5-7H,3-4,8,14H2,1-2H3.
What are the key properties of [6-(3,5-diethylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine?
[6-(3,5-diethylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine has a molecular weight of 275.38 g/mol, XLogP of 2.16, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(3,5-diethylpyrazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine is sourced from PubChem (CID 82694813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).