6-imidazo[2,1-b][1,3]thiazol-5-yl-N-[(2R,3R)-2-methylpiperidin-3-yl]pyrazin-2-amine

C15H18N6S — CID 58303387

IUPAC6-imidazo[2,1-b][1,3]thiazol-5-yl-N-[(2R,3R)-2-methylpiperidin-3-yl]pyrazin-2-amine
SMILESC[C@H]1NCCC[C@H]1Nc1cncc(-c2cnc3sccn23)n1
InChIInChI=1S/C15H18N6S/c1-10-11(3-2-4-17-10)19-14-9-16-7-12(20-14)13-8-18-15-21(13)5-6-22-15/h5-11,17H,2-4H2,1H3,(H,19,20)/t10-,11-/m1/s1
InChIKeyXFFKEYFYCKPFDE-GHMZBOCLSA-N
MW314.42 g/mol
LogP2.41
Rot. Bonds3

About 6-imidazo[2,1-b][1,3]thiazol-5-yl-N-[(2R,3R)-2-methylpiperidin-3-yl]pyrazin-2-amine

6-imidazo[2,1-b][1,3]thiazol-5-yl-N-[(2R,3R)-2-methylpiperidin-3-yl]pyrazin-2-amine (PubChem CID 58303387) has the molecular formula C15H18N6S and a molecular weight of 314.42 g/mol. Its IUPAC name is 6-imidazo[2,1-b][1,3]thiazol-5-yl-N-[(2R,3R)-2-methylpiperidin-3-yl]pyrazin-2-amine.

Molecular Properties

Compound Name6-imidazo[2,1-b][1,3]thiazol-5-yl-N-[(2R,3R)-2-methylpiperidin-3-yl]pyrazin-2-amine
PubChem CID58303387
Molecular FormulaC15H18N6S
Molecular Weight314.42 g/mol
Exact Mass314.13
IUPAC Name6-imidazo[2,1-b][1,3]thiazol-5-yl-N-[(2R,3R)-2-methylpiperidin-3-yl]pyrazin-2-amine
SMILESC[C@H]1NCCC[C@H]1Nc1cncc(-c2cnc3sccn23)n1
InChIInChI=1S/C15H18N6S/c1-10-11(3-2-4-17-10)19-14-9-16-7-12(20-14)13-8-18-15-21(13)5-6-22-15/h5-11,17H,2-4H2,1H3,(H,19,20)/t10-,11-/m1/s1
InChIKeyXFFKEYFYCKPFDE-GHMZBOCLSA-N
XLogP2.41
TPSA67.14 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.42
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 6-imidazo[2,1-b][1,3]thiazol-5-yl-N-[(2R,3R)-2-methylpiperidin-3-yl]pyrazin-2-amine?
The IUPAC name of 6-imidazo[2,1-b][1,3]thiazol-5-yl-N-[(2R,3R)-2-methylpiperidin-3-yl]pyrazin-2-amine (CID 58303387) is 6-imidazo[2,1-b][1,3]thiazol-5-yl-N-[(2R,3R)-2-methylpiperidin-3-yl]pyrazin-2-amine.
What is the SMILES notation for 6-imidazo[2,1-b][1,3]thiazol-5-yl-N-[(2R,3R)-2-methylpiperidin-3-yl]pyrazin-2-amine?
The canonical SMILES for 6-imidazo[2,1-b][1,3]thiazol-5-yl-N-[(2R,3R)-2-methylpiperidin-3-yl]pyrazin-2-amine is C[C@H]1NCCC[C@H]1Nc1cncc(-c2cnc3sccn23)n1.
What is the InChIKey of 6-imidazo[2,1-b][1,3]thiazol-5-yl-N-[(2R,3R)-2-methylpiperidin-3-yl]pyrazin-2-amine?
The InChIKey is XFFKEYFYCKPFDE-GHMZBOCLSA-N. The full InChI is InChI=1S/C15H18N6S/c1-10-11(3-2-4-17-10)19-14-9-16-7-12(20-14)13-8-18-15-21(13)5-6-22-15/h5-11,17H,2-4H2,1H3,(H,19,20)/t10-,11-/m1/s1.
What are the key properties of 6-imidazo[2,1-b][1,3]thiazol-5-yl-N-[(2R,3R)-2-methylpiperidin-3-yl]pyrazin-2-amine?
6-imidazo[2,1-b][1,3]thiazol-5-yl-N-[(2R,3R)-2-methylpiperidin-3-yl]pyrazin-2-amine has a molecular weight of 314.42 g/mol, XLogP of 2.41, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-imidazo[2,1-b][1,3]thiazol-5-yl-N-[(2R,3R)-2-methylpiperidin-3-yl]pyrazin-2-amine is sourced from PubChem (CID 58303387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).