1-[6-(1-methyltetrazol-5-yl)sulfanylimidazo[2,1-b][1,3]thiazol-5-yl]propan-2-amine

C10H13N7S2 — CID 63820444

IUPAC1-[6-(1-methyltetrazol-5-yl)sulfanylimidazo[2,1-b][1,3]thiazol-5-yl]propan-2-amine
SMILESCC(N)Cc1c(Sc2nnnn2C)nc2sccn12
InChIInChI=1S/C10H13N7S2/c1-6(11)5-7-8(12-9-17(7)3-4-18-9)19-10-13-14-15-16(10)2/h3-4,6H,5,11H2,1-2H3
InChIKeyHSNPCPCJZHURQG-UHFFFAOYSA-N
MW295.40 g/mol
LogP0.96
Rot. Bonds4

About 1-[6-(1-methyltetrazol-5-yl)sulfanylimidazo[2,1-b][1,3]thiazol-5-yl]propan-2-amine

1-[6-(1-methyltetrazol-5-yl)sulfanylimidazo[2,1-b][1,3]thiazol-5-yl]propan-2-amine (PubChem CID 63820444) has the molecular formula C10H13N7S2 and a molecular weight of 295.40 g/mol. Its IUPAC name is 1-[6-(1-methyltetrazol-5-yl)sulfanylimidazo[2,1-b][1,3]thiazol-5-yl]propan-2-amine.

Molecular Properties

Compound Name1-[6-(1-methyltetrazol-5-yl)sulfanylimidazo[2,1-b][1,3]thiazol-5-yl]propan-2-amine
PubChem CID63820444
Molecular FormulaC10H13N7S2
Molecular Weight295.40 g/mol
Exact Mass295.07
IUPAC Name1-[6-(1-methyltetrazol-5-yl)sulfanylimidazo[2,1-b][1,3]thiazol-5-yl]propan-2-amine
SMILESCC(N)Cc1c(Sc2nnnn2C)nc2sccn12
InChIInChI=1S/C10H13N7S2/c1-6(11)5-7-8(12-9-17(7)3-4-18-9)19-10-13-14-15-16(10)2/h3-4,6H,5,11H2,1-2H3
InChIKeyHSNPCPCJZHURQG-UHFFFAOYSA-N
XLogP0.96
TPSA86.92 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.40
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

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Related Compounds

1-[2-(1-methyltetrazol-5-yl)sulfanylimidazo[1,2-a]pyridin-3-yl]propan-2-amine
CID 63819265
3-[5-(2-aminopropyl)imidazo[2,1-b][1,3]thiazol-6-yl]sulfanyl-4-methyl-1H-1,2,4-triazol-5-one
CID 63817826
1-[6-(2,5-dichlorophenyl)sulfanylimidazo[2,1-b][1,3]thiazol-5-yl]propan-2-amine
CID 63820287
5-(2-aminopropyl)-N-(2-methylpropyl)-N-propan-2-ylimidazo[2,1-b][1,3]thiazol-6-amine
CID 63815676
1-(6-piperidin-1-ylimidazo[2,1-b][1,3]thiazol-5-yl)propan-2-amine
CID 63785604
1-[6-(4-methylpyrimidin-2-yl)sulfanylimidazo[2,1-b][1,3]thiazol-5-yl]butan-2-amine
CID 63819682
1-[6-(4,5-dimethylimidazol-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]propan-2-amine
CID 63815717
[6-(2-methylphenyl)sulfanylimidazo[2,1-b][1,3]thiazol-5-yl]methanamine
CID 63809988
N-[[6-(2,5-dimethylpyrazol-3-yl)sulfanylimidazo[2,1-b][1,3]thiazol-5-yl]methyl]propan-2-amine
CID 63809866
5-(2-aminopropyl)-N-butyl-N-cyclopropylimidazo[2,1-b][1,3]thiazol-6-amine
CID 63816316
1-[6-(2-ethylpiperidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]propan-2-amine
CID 63787125
1-[5-(2-aminopropyl)imidazo[2,1-b][1,3]thiazol-6-yl]-N,N,4-trimethylpyrrolidin-3-amine
CID 81464392

Frequently Asked Questions

What is the IUPAC name of 1-[6-(1-methyltetrazol-5-yl)sulfanylimidazo[2,1-b][1,3]thiazol-5-yl]propan-2-amine?
The IUPAC name of 1-[6-(1-methyltetrazol-5-yl)sulfanylimidazo[2,1-b][1,3]thiazol-5-yl]propan-2-amine (CID 63820444) is 1-[6-(1-methyltetrazol-5-yl)sulfanylimidazo[2,1-b][1,3]thiazol-5-yl]propan-2-amine.
What is the SMILES notation for 1-[6-(1-methyltetrazol-5-yl)sulfanylimidazo[2,1-b][1,3]thiazol-5-yl]propan-2-amine?
The canonical SMILES for 1-[6-(1-methyltetrazol-5-yl)sulfanylimidazo[2,1-b][1,3]thiazol-5-yl]propan-2-amine is CC(N)Cc1c(Sc2nnnn2C)nc2sccn12.
What is the InChIKey of 1-[6-(1-methyltetrazol-5-yl)sulfanylimidazo[2,1-b][1,3]thiazol-5-yl]propan-2-amine?
The InChIKey is HSNPCPCJZHURQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N7S2/c1-6(11)5-7-8(12-9-17(7)3-4-18-9)19-10-13-14-15-16(10)2/h3-4,6H,5,11H2,1-2H3.
What are the key properties of 1-[6-(1-methyltetrazol-5-yl)sulfanylimidazo[2,1-b][1,3]thiazol-5-yl]propan-2-amine?
1-[6-(1-methyltetrazol-5-yl)sulfanylimidazo[2,1-b][1,3]thiazol-5-yl]propan-2-amine has a molecular weight of 295.40 g/mol, XLogP of 0.96, 4 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-(1-methyltetrazol-5-yl)sulfanylimidazo[2,1-b][1,3]thiazol-5-yl]propan-2-amine is sourced from PubChem (CID 63820444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).