6-(2-methyl-1,3-thiazol-5-yl)-5-quinolin-6-ylpyrazin-2-amine

C17H13N5S — CID 137423724

IUPAC6-(2-methyl-1,3-thiazol-5-yl)-5-quinolin-6-ylpyrazin-2-amine
SMILESCc1ncc(-c2nc(N)cnc2-c2ccc3ncccc3c2)s1
InChIInChI=1S/C17H13N5S/c1-10-20-8-14(23-10)17-16(21-9-15(18)22-17)12-4-5-13-11(7-12)3-2-6-19-13/h2-9H,1H3,(H2,18,22)
InChIKeyKNCSCJPMZRXVTK-UHFFFAOYSA-N
MW319.39 g/mol
LogP3.71
Rot. Bonds2

About 6-(2-methyl-1,3-thiazol-5-yl)-5-quinolin-6-ylpyrazin-2-amine

6-(2-methyl-1,3-thiazol-5-yl)-5-quinolin-6-ylpyrazin-2-amine (PubChem CID 137423724) has the molecular formula C17H13N5S and a molecular weight of 319.39 g/mol. Its IUPAC name is 6-(2-methyl-1,3-thiazol-5-yl)-5-quinolin-6-ylpyrazin-2-amine.

Molecular Properties

Compound Name6-(2-methyl-1,3-thiazol-5-yl)-5-quinolin-6-ylpyrazin-2-amine
PubChem CID137423724
Molecular FormulaC17H13N5S
Molecular Weight319.39 g/mol
Exact Mass319.09
IUPAC Name6-(2-methyl-1,3-thiazol-5-yl)-5-quinolin-6-ylpyrazin-2-amine
SMILESCc1ncc(-c2nc(N)cnc2-c2ccc3ncccc3c2)s1
InChIInChI=1S/C17H13N5S/c1-10-20-8-14(23-10)17-16(21-9-15(18)22-17)12-4-5-13-11(7-12)3-2-6-19-13/h2-9H,1H3,(H2,18,22)
InChIKeyKNCSCJPMZRXVTK-UHFFFAOYSA-N
XLogP3.71
TPSA77.58 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.39
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-(2-methyl-1,3-thiazol-5-yl)-5-quinolin-6-ylpyrazin-2-amine?
The IUPAC name of 6-(2-methyl-1,3-thiazol-5-yl)-5-quinolin-6-ylpyrazin-2-amine (CID 137423724) is 6-(2-methyl-1,3-thiazol-5-yl)-5-quinolin-6-ylpyrazin-2-amine.
What is the SMILES notation for 6-(2-methyl-1,3-thiazol-5-yl)-5-quinolin-6-ylpyrazin-2-amine?
The canonical SMILES for 6-(2-methyl-1,3-thiazol-5-yl)-5-quinolin-6-ylpyrazin-2-amine is Cc1ncc(-c2nc(N)cnc2-c2ccc3ncccc3c2)s1.
What is the InChIKey of 6-(2-methyl-1,3-thiazol-5-yl)-5-quinolin-6-ylpyrazin-2-amine?
The InChIKey is KNCSCJPMZRXVTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13N5S/c1-10-20-8-14(23-10)17-16(21-9-15(18)22-17)12-4-5-13-11(7-12)3-2-6-19-13/h2-9H,1H3,(H2,18,22).
What are the key properties of 6-(2-methyl-1,3-thiazol-5-yl)-5-quinolin-6-ylpyrazin-2-amine?
6-(2-methyl-1,3-thiazol-5-yl)-5-quinolin-6-ylpyrazin-2-amine has a molecular weight of 319.39 g/mol, XLogP of 3.71, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-methyl-1,3-thiazol-5-yl)-5-quinolin-6-ylpyrazin-2-amine is sourced from PubChem (CID 137423724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).