2-[6-(4-bromopyrazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]ethanamine

C10H10BrN5S — CID 63816427

IUPAC2-[6-(4-bromopyrazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]ethanamine
SMILESNCCc1c(-n2cc(Br)cn2)nc2sccn12
InChIInChI=1S/C10H10BrN5S/c11-7-5-13-16(6-7)9-8(1-2-12)15-3-4-17-10(15)14-9/h3-6H,1-2,12H2
InChIKeyZGFRLLJLLIZSFP-UHFFFAOYSA-N
MW312.20 g/mol
LogP1.85
Rot. Bonds3

About 2-[6-(4-bromopyrazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]ethanamine

2-[6-(4-bromopyrazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]ethanamine (PubChem CID 63816427) has the molecular formula C10H10BrN5S and a molecular weight of 312.20 g/mol. Its IUPAC name is 2-[6-(4-bromopyrazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]ethanamine.

Molecular Properties

Compound Name2-[6-(4-bromopyrazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]ethanamine
PubChem CID63816427
Molecular FormulaC10H10BrN5S
Molecular Weight312.20 g/mol
Exact Mass310.98
IUPAC Name2-[6-(4-bromopyrazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]ethanamine
SMILESNCCc1c(-n2cc(Br)cn2)nc2sccn12
InChIInChI=1S/C10H10BrN5S/c11-7-5-13-16(6-7)9-8(1-2-12)15-3-4-17-10(15)14-9/h3-6H,1-2,12H2
InChIKeyZGFRLLJLLIZSFP-UHFFFAOYSA-N
XLogP1.85
TPSA61.14 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.20
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1-[6-(4-bromopyrazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]butan-2-amine
CID 63815377
2-[6-(azocan-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]ethanamine
CID 55236378
2-[6-(3,4-dimethylpyrrolidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]ethanamine
CID 79183495
2-[6-(1-oxo-1,4-thiazinan-4-yl)imidazo[2,1-b][1,3]thiazol-5-yl]ethanamine
CID 63786021
2-[6-(4-bromophenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]ethanamine
CID 63802425
[2-(4-bromopyrazol-1-yl)imidazo[1,2-a]pyridin-3-yl]methanamine
CID 54909750
2-[6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]imidazo[2,1-b][1,3]thiazol-5-yl]ethanamine
CID 104961298
2-[6-(8-azaspiro[4.5]decan-8-yl)imidazo[2,1-b][1,3]thiazol-5-yl]ethanamine
CID 63783269
5-(2-aminoethyl)-N-[(4-bromophenyl)methyl]-N-methylimidazo[2,1-b][1,3]thiazol-6-amine
CID 63786892
2-[6-(2,3-dimethylpiperidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]ethanamine
CID 63783425
2-(6-butylsulfanylimidazo[2,1-b][1,3]thiazol-5-yl)ethanamine
CID 63818995
2-[6-(3-bromo-5-fluorophenoxy)imidazo[2,1-b][1,3]thiazol-5-yl]ethanamine
CID 81325942

Frequently Asked Questions

What is the IUPAC name of 2-[6-(4-bromopyrazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]ethanamine?
The IUPAC name of 2-[6-(4-bromopyrazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]ethanamine (CID 63816427) is 2-[6-(4-bromopyrazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]ethanamine.
What is the SMILES notation for 2-[6-(4-bromopyrazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]ethanamine?
The canonical SMILES for 2-[6-(4-bromopyrazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]ethanamine is NCCc1c(-n2cc(Br)cn2)nc2sccn12.
What is the InChIKey of 2-[6-(4-bromopyrazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]ethanamine?
The InChIKey is ZGFRLLJLLIZSFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10BrN5S/c11-7-5-13-16(6-7)9-8(1-2-12)15-3-4-17-10(15)14-9/h3-6H,1-2,12H2.
What are the key properties of 2-[6-(4-bromopyrazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]ethanamine?
2-[6-(4-bromopyrazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]ethanamine has a molecular weight of 312.20 g/mol, XLogP of 1.85, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-(4-bromopyrazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]ethanamine is sourced from PubChem (CID 63816427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).