2-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)imidazo[1,2-a]pyridine-3-carboxamide

C17H14N4OS — CID 43952298

IUPAC2-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)imidazo[1,2-a]pyridine-3-carboxamide
SMILESCc1ccc2nc(NC(=O)c3c(C)nc4ccccn34)sc2c1
InChIInChI=1S/C17H14N4OS/c1-10-6-7-12-13(9-10)23-17(19-12)20-16(22)15-11(2)18-14-5-3-4-8-21(14)15/h3-9H,1-2H3,(H,19,20,22)
InChIKeyBNUGLXUGELXZMK-UHFFFAOYSA-N
MW322.39 g/mol
LogP3.81
Rot. Bonds2

About 2-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)imidazo[1,2-a]pyridine-3-carboxamide

2-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)imidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 43952298) has the molecular formula C17H14N4OS and a molecular weight of 322.39 g/mol. Its IUPAC name is 2-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)imidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound Name2-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)imidazo[1,2-a]pyridine-3-carboxamide
PubChem CID43952298
Molecular FormulaC17H14N4OS
Molecular Weight322.39 g/mol
Exact Mass322.09
IUPAC Name2-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)imidazo[1,2-a]pyridine-3-carboxamide
SMILESCc1ccc2nc(NC(=O)c3c(C)nc4ccccn34)sc2c1
InChIInChI=1S/C17H14N4OS/c1-10-6-7-12-13(9-10)23-17(19-12)20-16(22)15-11(2)18-14-5-3-4-8-21(14)15/h3-9H,1-2H3,(H,19,20,22)
InChIKeyBNUGLXUGELXZMK-UHFFFAOYSA-N
XLogP3.81
TPSA59.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.39
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)imidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of 2-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)imidazo[1,2-a]pyridine-3-carboxamide (CID 43952298) is 2-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)imidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for 2-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)imidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for 2-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)imidazo[1,2-a]pyridine-3-carboxamide is Cc1ccc2nc(NC(=O)c3c(C)nc4ccccn34)sc2c1.
What is the InChIKey of 2-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)imidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is BNUGLXUGELXZMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N4OS/c1-10-6-7-12-13(9-10)23-17(19-12)20-16(22)15-11(2)18-14-5-3-4-8-21(14)15/h3-9H,1-2H3,(H,19,20,22).
What are the key properties of 2-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)imidazo[1,2-a]pyridine-3-carboxamide?
2-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)imidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 322.39 g/mol, XLogP of 3.81, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)imidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 43952298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).