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

C13H20N4S — CID 61421693

IUPAC[6-(4-ethylpiperidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine
SMILESCCC1CCN(c2nc3sccn3c2CN)CC1
InChIInChI=1S/C13H20N4S/c1-2-10-3-5-16(6-4-10)12-11(9-14)17-7-8-18-13(17)15-12/h7-8,10H,2-6,9,14H2,1H3
InChIKeySPVJJUCMIOOFQQ-UHFFFAOYSA-N
MW264.40 g/mol
LogP2.48
Rot. Bonds3

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

[6-(4-ethylpiperidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine (PubChem CID 61421693) has the molecular formula C13H20N4S and a molecular weight of 264.40 g/mol. Its IUPAC name is [6-(4-ethylpiperidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine.

Molecular Properties

Compound Name[6-(4-ethylpiperidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine
PubChem CID61421693
Molecular FormulaC13H20N4S
Molecular Weight264.40 g/mol
Exact Mass264.14
IUPAC Name[6-(4-ethylpiperidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine
SMILESCCC1CCN(c2nc3sccn3c2CN)CC1
InChIInChI=1S/C13H20N4S/c1-2-10-3-5-16(6-4-10)12-11(9-14)17-7-8-18-13(17)15-12/h7-8,10H,2-6,9,14H2,1H3
InChIKeySPVJJUCMIOOFQQ-UHFFFAOYSA-N
XLogP2.48
TPSA46.56 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.40
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [6-(4-ethylpiperidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine?
The IUPAC name of [6-(4-ethylpiperidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine (CID 61421693) is [6-(4-ethylpiperidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine.
What is the SMILES notation for [6-(4-ethylpiperidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine?
The canonical SMILES for [6-(4-ethylpiperidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine is CCC1CCN(c2nc3sccn3c2CN)CC1.
What is the InChIKey of [6-(4-ethylpiperidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine?
The InChIKey is SPVJJUCMIOOFQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4S/c1-2-10-3-5-16(6-4-10)12-11(9-14)17-7-8-18-13(17)15-12/h7-8,10H,2-6,9,14H2,1H3.
What are the key properties of [6-(4-ethylpiperidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine?
[6-(4-ethylpiperidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine has a molecular weight of 264.40 g/mol, XLogP of 2.48, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(4-ethylpiperidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine is sourced from PubChem (CID 61421693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).