1-[6-(4,5-dimethylimidazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]propan-2-amine

C13H17N5S — CID 63815717

IUPAC1-[6-(4,5-dimethylimidazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]propan-2-amine
SMILESCc1ncn(-c2nc3sccn3c2CC(C)N)c1C
InChIInChI=1S/C13H17N5S/c1-8(14)6-11-12(16-13-17(11)4-5-19-13)18-7-15-9(2)10(18)3/h4-5,7-8H,6,14H2,1-3H3
InChIKeyLSAFHVODABVWAV-UHFFFAOYSA-N
MW275.38 g/mol
LogP2.09
Rot. Bonds3

About 1-[6-(4,5-dimethylimidazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]propan-2-amine

1-[6-(4,5-dimethylimidazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]propan-2-amine (PubChem CID 63815717) has the molecular formula C13H17N5S and a molecular weight of 275.38 g/mol. Its IUPAC name is 1-[6-(4,5-dimethylimidazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]propan-2-amine.

Molecular Properties

Compound Name1-[6-(4,5-dimethylimidazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]propan-2-amine
PubChem CID63815717
Molecular FormulaC13H17N5S
Molecular Weight275.38 g/mol
Exact Mass275.12
IUPAC Name1-[6-(4,5-dimethylimidazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]propan-2-amine
SMILESCc1ncn(-c2nc3sccn3c2CC(C)N)c1C
InChIInChI=1S/C13H17N5S/c1-8(14)6-11-12(16-13-17(11)4-5-19-13)18-7-15-9(2)10(18)3/h4-5,7-8H,6,14H2,1-3H3
InChIKeyLSAFHVODABVWAV-UHFFFAOYSA-N
XLogP2.09
TPSA61.14 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.38
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1-[6-(2-methylimidazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]propan-2-amine
CID 63815708
N-[[6-(4,5-dimethylimidazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]-2-methylpropan-1-amine
CID 63071941
N-[[6-(4,5-dimethylimidazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]ethanamine
CID 62349710
1-(6-piperidin-1-ylimidazo[2,1-b][1,3]thiazol-5-yl)propan-2-amine
CID 63785604
1-[6-(2,2-dimethylpyrrolidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]propan-2-amine
CID 63795081
1-[6-(2-methylpyrrolidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]propan-2-amine
CID 55237176
1-[6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)imidazo[2,1-b][1,3]thiazol-5-yl]propan-2-amine
CID 63793480
1-[5-(2-aminopropyl)imidazo[2,1-b][1,3]thiazol-6-yl]-N,N,4-trimethylpyrrolidin-3-amine
CID 81464392
1-[6-(2-ethylpiperidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]propan-2-amine
CID 63787125
5-(2-aminopropyl)-N-methyl-N-(4-methylphenyl)imidazo[2,1-b][1,3]thiazol-6-amine
CID 63815102
5-(2-aminopropyl)-N-(2-methylpropyl)-N-propan-2-ylimidazo[2,1-b][1,3]thiazol-6-amine
CID 63815676
1-[6-(3-ethoxypiperidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]propan-2-amine
CID 63817268

Frequently Asked Questions

What is the IUPAC name of 1-[6-(4,5-dimethylimidazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]propan-2-amine?
The IUPAC name of 1-[6-(4,5-dimethylimidazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]propan-2-amine (CID 63815717) is 1-[6-(4,5-dimethylimidazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]propan-2-amine.
What is the SMILES notation for 1-[6-(4,5-dimethylimidazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]propan-2-amine?
The canonical SMILES for 1-[6-(4,5-dimethylimidazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]propan-2-amine is Cc1ncn(-c2nc3sccn3c2CC(C)N)c1C.
What is the InChIKey of 1-[6-(4,5-dimethylimidazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]propan-2-amine?
The InChIKey is LSAFHVODABVWAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N5S/c1-8(14)6-11-12(16-13-17(11)4-5-19-13)18-7-15-9(2)10(18)3/h4-5,7-8H,6,14H2,1-3H3.
What are the key properties of 1-[6-(4,5-dimethylimidazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]propan-2-amine?
1-[6-(4,5-dimethylimidazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]propan-2-amine has a molecular weight of 275.38 g/mol, XLogP of 2.09, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-(4,5-dimethylimidazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]propan-2-amine is sourced from PubChem (CID 63815717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).