N-methyl-2-thiophen-2-yl-1H-imidazo[4,5-b]pyridine-7-carboxamide

C12H10N4OS — CID 70810297

IUPACN-methyl-2-thiophen-2-yl-1H-imidazo[4,5-b]pyridine-7-carboxamide
SMILESCNC(=O)c1ccnc2nc(-c3cccs3)[nH]c12
InChIInChI=1S/C12H10N4OS/c1-13-12(17)7-4-5-14-11-9(7)15-10(16-11)8-3-2-6-18-8/h2-6H,1H3,(H,13,17)(H,14,15,16)
InChIKeyYZANOXNOOHPOJV-UHFFFAOYSA-N
MW258.31 g/mol
LogP2.05
Rot. Bonds2

About N-methyl-2-thiophen-2-yl-1H-imidazo[4,5-b]pyridine-7-carboxamide

N-methyl-2-thiophen-2-yl-1H-imidazo[4,5-b]pyridine-7-carboxamide (PubChem CID 70810297) has the molecular formula C12H10N4OS and a molecular weight of 258.31 g/mol. Its IUPAC name is N-methyl-2-thiophen-2-yl-1H-imidazo[4,5-b]pyridine-7-carboxamide.

Molecular Properties

Compound NameN-methyl-2-thiophen-2-yl-1H-imidazo[4,5-b]pyridine-7-carboxamide
PubChem CID70810297
Molecular FormulaC12H10N4OS
Molecular Weight258.31 g/mol
Exact Mass258.06
IUPAC NameN-methyl-2-thiophen-2-yl-1H-imidazo[4,5-b]pyridine-7-carboxamide
SMILESCNC(=O)c1ccnc2nc(-c3cccs3)[nH]c12
InChIInChI=1S/C12H10N4OS/c1-13-12(17)7-4-5-14-11-9(7)15-10(16-11)8-3-2-6-18-8/h2-6H,1H3,(H,13,17)(H,14,15,16)
InChIKeyYZANOXNOOHPOJV-UHFFFAOYSA-N
XLogP2.05
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.31
LogP ≤ 52.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-thiophen-2-yl-1H-imidazo[4,5-b]pyridine-7-carboxamide?
The IUPAC name of N-methyl-2-thiophen-2-yl-1H-imidazo[4,5-b]pyridine-7-carboxamide (CID 70810297) is N-methyl-2-thiophen-2-yl-1H-imidazo[4,5-b]pyridine-7-carboxamide.
What is the SMILES notation for N-methyl-2-thiophen-2-yl-1H-imidazo[4,5-b]pyridine-7-carboxamide?
The canonical SMILES for N-methyl-2-thiophen-2-yl-1H-imidazo[4,5-b]pyridine-7-carboxamide is CNC(=O)c1ccnc2nc(-c3cccs3)[nH]c12.
What is the InChIKey of N-methyl-2-thiophen-2-yl-1H-imidazo[4,5-b]pyridine-7-carboxamide?
The InChIKey is YZANOXNOOHPOJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N4OS/c1-13-12(17)7-4-5-14-11-9(7)15-10(16-11)8-3-2-6-18-8/h2-6H,1H3,(H,13,17)(H,14,15,16).
What are the key properties of N-methyl-2-thiophen-2-yl-1H-imidazo[4,5-b]pyridine-7-carboxamide?
N-methyl-2-thiophen-2-yl-1H-imidazo[4,5-b]pyridine-7-carboxamide has a molecular weight of 258.31 g/mol, XLogP of 2.05, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-thiophen-2-yl-1H-imidazo[4,5-b]pyridine-7-carboxamide is sourced from PubChem (CID 70810297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).