6-(2-methylimidazo[2,1-b][1,3]thiazol-5-yl)-N-(4-methylpyrrolidin-3-yl)pyrazin-2-amine

C15H18N6S — CID 76753364

IUPAC6-(2-methylimidazo[2,1-b][1,3]thiazol-5-yl)-N-(4-methylpyrrolidin-3-yl)pyrazin-2-amine
SMILESCc1cn2c(-c3cncc(NC4CNCC4C)n3)cnc2s1
InChIInChI=1S/C15H18N6S/c1-9-3-16-4-11(9)19-14-7-17-5-12(20-14)13-6-18-15-21(13)8-10(2)22-15/h5-9,11,16H,3-4H2,1-2H3,(H,19,20)
InChIKeyOXABZSINWDKCSP-UHFFFAOYSA-N
MW314.42 g/mol
LogP2.18
Rot. Bonds3

About 6-(2-methylimidazo[2,1-b][1,3]thiazol-5-yl)-N-(4-methylpyrrolidin-3-yl)pyrazin-2-amine

6-(2-methylimidazo[2,1-b][1,3]thiazol-5-yl)-N-(4-methylpyrrolidin-3-yl)pyrazin-2-amine (PubChem CID 76753364) has the molecular formula C15H18N6S and a molecular weight of 314.42 g/mol. Its IUPAC name is 6-(2-methylimidazo[2,1-b][1,3]thiazol-5-yl)-N-(4-methylpyrrolidin-3-yl)pyrazin-2-amine.

Molecular Properties

Compound Name6-(2-methylimidazo[2,1-b][1,3]thiazol-5-yl)-N-(4-methylpyrrolidin-3-yl)pyrazin-2-amine
PubChem CID76753364
Molecular FormulaC15H18N6S
Molecular Weight314.42 g/mol
Exact Mass314.13
IUPAC Name6-(2-methylimidazo[2,1-b][1,3]thiazol-5-yl)-N-(4-methylpyrrolidin-3-yl)pyrazin-2-amine
SMILESCc1cn2c(-c3cncc(NC4CNCC4C)n3)cnc2s1
InChIInChI=1S/C15H18N6S/c1-9-3-16-4-11(9)19-14-7-17-5-12(20-14)13-6-18-15-21(13)8-10(2)22-15/h5-9,11,16H,3-4H2,1-2H3,(H,19,20)
InChIKeyOXABZSINWDKCSP-UHFFFAOYSA-N
XLogP2.18
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 ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 6-(2-methylimidazo[2,1-b][1,3]thiazol-5-yl)-N-(4-methylpyrrolidin-3-yl)pyrazin-2-amine?
The IUPAC name of 6-(2-methylimidazo[2,1-b][1,3]thiazol-5-yl)-N-(4-methylpyrrolidin-3-yl)pyrazin-2-amine (CID 76753364) is 6-(2-methylimidazo[2,1-b][1,3]thiazol-5-yl)-N-(4-methylpyrrolidin-3-yl)pyrazin-2-amine.
What is the SMILES notation for 6-(2-methylimidazo[2,1-b][1,3]thiazol-5-yl)-N-(4-methylpyrrolidin-3-yl)pyrazin-2-amine?
The canonical SMILES for 6-(2-methylimidazo[2,1-b][1,3]thiazol-5-yl)-N-(4-methylpyrrolidin-3-yl)pyrazin-2-amine is Cc1cn2c(-c3cncc(NC4CNCC4C)n3)cnc2s1.
What is the InChIKey of 6-(2-methylimidazo[2,1-b][1,3]thiazol-5-yl)-N-(4-methylpyrrolidin-3-yl)pyrazin-2-amine?
The InChIKey is OXABZSINWDKCSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N6S/c1-9-3-16-4-11(9)19-14-7-17-5-12(20-14)13-6-18-15-21(13)8-10(2)22-15/h5-9,11,16H,3-4H2,1-2H3,(H,19,20).
What are the key properties of 6-(2-methylimidazo[2,1-b][1,3]thiazol-5-yl)-N-(4-methylpyrrolidin-3-yl)pyrazin-2-amine?
6-(2-methylimidazo[2,1-b][1,3]thiazol-5-yl)-N-(4-methylpyrrolidin-3-yl)pyrazin-2-amine has a molecular weight of 314.42 g/mol, XLogP of 2.18, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-methylimidazo[2,1-b][1,3]thiazol-5-yl)-N-(4-methylpyrrolidin-3-yl)pyrazin-2-amine is sourced from PubChem (CID 76753364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).