2-hydroxy-N-(2-imidazo[1,2-a]pyridin-5-ylsulfanylethyl)benzamide

C16H15N3O2S — CID 23362977

IUPAC2-hydroxy-N-(2-imidazo[1,2-a]pyridin-5-ylsulfanylethyl)benzamide
SMILESO=C(NCCSc1cccc2nccn12)c1ccccc1O
InChIInChI=1S/C16H15N3O2S/c20-13-5-2-1-4-12(13)16(21)18-9-11-22-15-7-3-6-14-17-8-10-19(14)15/h1-8,10,20H,9,11H2,(H,18,21)
InChIKeyRYULPSNGITWHAA-UHFFFAOYSA-N
MW313.38 g/mol
LogP2.56
Rot. Bonds5

About 2-hydroxy-N-(2-imidazo[1,2-a]pyridin-5-ylsulfanylethyl)benzamide

2-hydroxy-N-(2-imidazo[1,2-a]pyridin-5-ylsulfanylethyl)benzamide (PubChem CID 23362977) has the molecular formula C16H15N3O2S and a molecular weight of 313.38 g/mol. Its IUPAC name is 2-hydroxy-N-(2-imidazo[1,2-a]pyridin-5-ylsulfanylethyl)benzamide.

Molecular Properties

Compound Name2-hydroxy-N-(2-imidazo[1,2-a]pyridin-5-ylsulfanylethyl)benzamide
PubChem CID23362977
Molecular FormulaC16H15N3O2S
Molecular Weight313.38 g/mol
Exact Mass313.09
IUPAC Name2-hydroxy-N-(2-imidazo[1,2-a]pyridin-5-ylsulfanylethyl)benzamide
SMILESO=C(NCCSc1cccc2nccn12)c1ccccc1O
InChIInChI=1S/C16H15N3O2S/c20-13-5-2-1-4-12(13)16(21)18-9-11-22-15-7-3-6-14-17-8-10-19(14)15/h1-8,10,20H,9,11H2,(H,18,21)
InChIKeyRYULPSNGITWHAA-UHFFFAOYSA-N
XLogP2.56
TPSA66.63 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.38
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 2-hydroxy-N-(2-imidazo[1,2-a]pyridin-5-ylsulfanylethyl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-(2-imidazo[1,2-a]pyridin-5-ylsulfanylethyl)benzamide?
The IUPAC name of 2-hydroxy-N-(2-imidazo[1,2-a]pyridin-5-ylsulfanylethyl)benzamide (CID 23362977) is 2-hydroxy-N-(2-imidazo[1,2-a]pyridin-5-ylsulfanylethyl)benzamide.
What is the SMILES notation for 2-hydroxy-N-(2-imidazo[1,2-a]pyridin-5-ylsulfanylethyl)benzamide?
The canonical SMILES for 2-hydroxy-N-(2-imidazo[1,2-a]pyridin-5-ylsulfanylethyl)benzamide is O=C(NCCSc1cccc2nccn12)c1ccccc1O.
What is the InChIKey of 2-hydroxy-N-(2-imidazo[1,2-a]pyridin-5-ylsulfanylethyl)benzamide?
The InChIKey is RYULPSNGITWHAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O2S/c20-13-5-2-1-4-12(13)16(21)18-9-11-22-15-7-3-6-14-17-8-10-19(14)15/h1-8,10,20H,9,11H2,(H,18,21).
What are the key properties of 2-hydroxy-N-(2-imidazo[1,2-a]pyridin-5-ylsulfanylethyl)benzamide?
2-hydroxy-N-(2-imidazo[1,2-a]pyridin-5-ylsulfanylethyl)benzamide has a molecular weight of 313.38 g/mol, XLogP of 2.56, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-(2-imidazo[1,2-a]pyridin-5-ylsulfanylethyl)benzamide is sourced from PubChem (CID 23362977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).