N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide

C13H11N3OS — CID 134791397

IUPACN-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide
SMILESO=C(NCc1cccs1)c1ccc2nccn2c1
InChIInChI=1S/C13H11N3OS/c17-13(15-8-11-2-1-7-18-11)10-3-4-12-14-5-6-16(12)9-10/h1-7,9H,8H2,(H,15,17)
InChIKeyGLRNDQSCJGBWGK-UHFFFAOYSA-N
MW257.32 g/mol
LogP2.33
Rot. Bonds3

About N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide

N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide (PubChem CID 134791397) has the molecular formula C13H11N3OS and a molecular weight of 257.32 g/mol. Its IUPAC name is N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide.

Molecular Properties

Compound NameN-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide
PubChem CID134791397
Molecular FormulaC13H11N3OS
Molecular Weight257.32 g/mol
Exact Mass257.06
IUPAC NameN-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide
SMILESO=C(NCc1cccs1)c1ccc2nccn2c1
InChIInChI=1S/C13H11N3OS/c17-13(15-8-11-2-1-7-18-11)10-3-4-12-14-5-6-16(12)9-10/h1-7,9H,8H2,(H,15,17)
InChIKeyGLRNDQSCJGBWGK-UHFFFAOYSA-N
XLogP2.33
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.32
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide?
The IUPAC name of N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide (CID 134791397) is N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide.
What is the SMILES notation for N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide?
The canonical SMILES for N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide is O=C(NCc1cccs1)c1ccc2nccn2c1.
What is the InChIKey of N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide?
The InChIKey is GLRNDQSCJGBWGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N3OS/c17-13(15-8-11-2-1-7-18-11)10-3-4-12-14-5-6-16(12)9-10/h1-7,9H,8H2,(H,15,17).
What are the key properties of N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide?
N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide has a molecular weight of 257.32 g/mol, XLogP of 2.33, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide is sourced from PubChem (CID 134791397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).