2-[4-[5-(aminomethyl)imidazo[2,1-b][1,3]thiazol-6-yl]piperazin-1-yl]-N,N-dimethylethanamine

C14H24N6S — CID 62887757

IUPAC2-[4-[5-(aminomethyl)imidazo[2,1-b][1,3]thiazol-6-yl]piperazin-1-yl]-N,N-dimethylethanamine
SMILESCN(C)CCN1CCN(c2nc3sccn3c2CN)CC1
InChIInChI=1S/C14H24N6S/c1-17(2)3-4-18-5-7-19(8-6-18)13-12(11-15)20-9-10-21-14(20)16-13/h9-10H,3-8,11,15H2,1-2H3
InChIKeyVBWBMZKPUUOOES-UHFFFAOYSA-N
MW308.45 g/mol
LogP0.54
Rot. Bonds5

About 2-[4-[5-(aminomethyl)imidazo[2,1-b][1,3]thiazol-6-yl]piperazin-1-yl]-N,N-dimethylethanamine

2-[4-[5-(aminomethyl)imidazo[2,1-b][1,3]thiazol-6-yl]piperazin-1-yl]-N,N-dimethylethanamine (PubChem CID 62887757) has the molecular formula C14H24N6S and a molecular weight of 308.45 g/mol. Its IUPAC name is 2-[4-[5-(aminomethyl)imidazo[2,1-b][1,3]thiazol-6-yl]piperazin-1-yl]-N,N-dimethylethanamine.

Molecular Properties

Compound Name2-[4-[5-(aminomethyl)imidazo[2,1-b][1,3]thiazol-6-yl]piperazin-1-yl]-N,N-dimethylethanamine
PubChem CID62887757
Molecular FormulaC14H24N6S
Molecular Weight308.45 g/mol
Exact Mass308.18
IUPAC Name2-[4-[5-(aminomethyl)imidazo[2,1-b][1,3]thiazol-6-yl]piperazin-1-yl]-N,N-dimethylethanamine
SMILESCN(C)CCN1CCN(c2nc3sccn3c2CN)CC1
InChIInChI=1S/C14H24N6S/c1-17(2)3-4-18-5-7-19(8-6-18)13-12(11-15)20-9-10-21-14(20)16-13/h9-10H,3-8,11,15H2,1-2H3
InChIKeyVBWBMZKPUUOOES-UHFFFAOYSA-N
XLogP0.54
TPSA53.04 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.45
LogP ≤ 50.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

[6-(4-ethylpiperazin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine
CID 43476364
(6-thiomorpholin-4-ylimidazo[2,1-b][1,3]thiazol-5-yl)methanamine
CID 43476395
[6-(4-ethylpiperidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine
CID 61421693
[6-(3-azaspiro[5.5]undecan-3-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine
CID 62931604
1-[1-[5-(aminomethyl)imidazo[2,1-b][1,3]thiazol-6-yl]pyrrolidin-2-yl]-N,N-dimethylmethanamine
CID 55128569
1-[5-(aminomethyl)imidazo[2,1-b][1,3]thiazol-6-yl]-3-methylpiperidin-4-ol
CID 114679350
2-[6-(azocan-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]ethanamine
CID 55236378
2-methyl-N-[[6-(4-methylpiperazin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]propan-2-amine
CID 63058722
1-(6-piperidin-1-ylimidazo[2,1-b][1,3]thiazol-5-yl)propan-2-amine
CID 63785604
2-[1-[5-(aminomethyl)imidazo[2,1-b][1,3]thiazol-6-yl]piperidin-3-yl]ethanol
CID 107228114
1-[6-[4-(cyclopropylmethyl)piperazin-1-yl]imidazo[2,1-b][1,3]thiazol-5-yl]-N-methylmethanamine
CID 61445305
N-methyl-1-(6-pyrrolidin-1-ylimidazo[2,1-b][1,3]thiazol-5-yl)methanamine
CID 43476211

Frequently Asked Questions

What is the IUPAC name of 2-[4-[5-(aminomethyl)imidazo[2,1-b][1,3]thiazol-6-yl]piperazin-1-yl]-N,N-dimethylethanamine?
The IUPAC name of 2-[4-[5-(aminomethyl)imidazo[2,1-b][1,3]thiazol-6-yl]piperazin-1-yl]-N,N-dimethylethanamine (CID 62887757) is 2-[4-[5-(aminomethyl)imidazo[2,1-b][1,3]thiazol-6-yl]piperazin-1-yl]-N,N-dimethylethanamine.
What is the SMILES notation for 2-[4-[5-(aminomethyl)imidazo[2,1-b][1,3]thiazol-6-yl]piperazin-1-yl]-N,N-dimethylethanamine?
The canonical SMILES for 2-[4-[5-(aminomethyl)imidazo[2,1-b][1,3]thiazol-6-yl]piperazin-1-yl]-N,N-dimethylethanamine is CN(C)CCN1CCN(c2nc3sccn3c2CN)CC1.
What is the InChIKey of 2-[4-[5-(aminomethyl)imidazo[2,1-b][1,3]thiazol-6-yl]piperazin-1-yl]-N,N-dimethylethanamine?
The InChIKey is VBWBMZKPUUOOES-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N6S/c1-17(2)3-4-18-5-7-19(8-6-18)13-12(11-15)20-9-10-21-14(20)16-13/h9-10H,3-8,11,15H2,1-2H3.
What are the key properties of 2-[4-[5-(aminomethyl)imidazo[2,1-b][1,3]thiazol-6-yl]piperazin-1-yl]-N,N-dimethylethanamine?
2-[4-[5-(aminomethyl)imidazo[2,1-b][1,3]thiazol-6-yl]piperazin-1-yl]-N,N-dimethylethanamine has a molecular weight of 308.45 g/mol, XLogP of 0.54, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[5-(aminomethyl)imidazo[2,1-b][1,3]thiazol-6-yl]piperazin-1-yl]-N,N-dimethylethanamine is sourced from PubChem (CID 62887757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).