imidazo[2,1-b][1,3]thiazol-5-ylmethanamine

C6H7N3S — CID 82416838

IUPACimidazo[2,1-b][1,3]thiazol-5-ylmethanamine
SMILESNCc1cnc2sccn12
InChIInChI=1S/C6H7N3S/c7-3-5-4-8-6-9(5)1-2-10-6/h1-2,4H,3,7H2
InChIKeyKKXVXXAFXMPTMT-UHFFFAOYSA-N
MW153.21 g/mol
LogP0.85
Rot. Bonds1

About imidazo[2,1-b][1,3]thiazol-5-ylmethanamine

imidazo[2,1-b][1,3]thiazol-5-ylmethanamine (PubChem CID 82416838) has the molecular formula C6H7N3S and a molecular weight of 153.21 g/mol. Its IUPAC name is imidazo[2,1-b][1,3]thiazol-5-ylmethanamine.

Molecular Properties

Compound Nameimidazo[2,1-b][1,3]thiazol-5-ylmethanamine
PubChem CID82416838
Molecular FormulaC6H7N3S
Molecular Weight153.21 g/mol
Exact Mass153.04
IUPAC Nameimidazo[2,1-b][1,3]thiazol-5-ylmethanamine
SMILESNCc1cnc2sccn12
InChIInChI=1S/C6H7N3S/c7-3-5-4-8-6-9(5)1-2-10-6/h1-2,4H,3,7H2
InChIKeyKKXVXXAFXMPTMT-UHFFFAOYSA-N
XLogP0.85
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.21
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of imidazo[2,1-b][1,3]thiazol-5-ylmethanamine?
The IUPAC name of imidazo[2,1-b][1,3]thiazol-5-ylmethanamine (CID 82416838) is imidazo[2,1-b][1,3]thiazol-5-ylmethanamine.
What is the SMILES notation for imidazo[2,1-b][1,3]thiazol-5-ylmethanamine?
The canonical SMILES for imidazo[2,1-b][1,3]thiazol-5-ylmethanamine is NCc1cnc2sccn12.
What is the InChIKey of imidazo[2,1-b][1,3]thiazol-5-ylmethanamine?
The InChIKey is KKXVXXAFXMPTMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7N3S/c7-3-5-4-8-6-9(5)1-2-10-6/h1-2,4H,3,7H2.
What are the key properties of imidazo[2,1-b][1,3]thiazol-5-ylmethanamine?
imidazo[2,1-b][1,3]thiazol-5-ylmethanamine has a molecular weight of 153.21 g/mol, XLogP of 0.85, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for imidazo[2,1-b][1,3]thiazol-5-ylmethanamine is sourced from PubChem (CID 82416838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).