N-(2-imidazo[1,2-a]pyridin-5-ylsulfanylethyl)pyridine-3-carboxamide

C15H14N4OS — CID 23362816

IUPACN-(2-imidazo[1,2-a]pyridin-5-ylsulfanylethyl)pyridine-3-carboxamide
SMILESO=C(NCCSc1cccc2nccn12)c1cccnc1
InChIInChI=1S/C15H14N4OS/c20-15(12-3-2-6-16-11-12)18-8-10-21-14-5-1-4-13-17-7-9-19(13)14/h1-7,9,11H,8,10H2,(H,18,20)
InChIKeyFUIOROVXECCSCY-UHFFFAOYSA-N
MW298.37 g/mol
LogP2.25
Rot. Bonds5

About N-(2-imidazo[1,2-a]pyridin-5-ylsulfanylethyl)pyridine-3-carboxamide

N-(2-imidazo[1,2-a]pyridin-5-ylsulfanylethyl)pyridine-3-carboxamide (PubChem CID 23362816) has the molecular formula C15H14N4OS and a molecular weight of 298.37 g/mol. Its IUPAC name is N-(2-imidazo[1,2-a]pyridin-5-ylsulfanylethyl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-imidazo[1,2-a]pyridin-5-ylsulfanylethyl)pyridine-3-carboxamide
PubChem CID23362816
Molecular FormulaC15H14N4OS
Molecular Weight298.37 g/mol
Exact Mass298.09
IUPAC NameN-(2-imidazo[1,2-a]pyridin-5-ylsulfanylethyl)pyridine-3-carboxamide
SMILESO=C(NCCSc1cccc2nccn12)c1cccnc1
InChIInChI=1S/C15H14N4OS/c20-15(12-3-2-6-16-11-12)18-8-10-21-14-5-1-4-13-17-7-9-19(13)14/h1-7,9,11H,8,10H2,(H,18,20)
InChIKeyFUIOROVXECCSCY-UHFFFAOYSA-N
XLogP2.25
TPSA59.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.37
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze N-(2-imidazo[1,2-a]pyridin-5-ylsulfanylethyl)pyridine-3-carboxamide with MolForge

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

Launch Full Analysis

Related Compounds

N-(3-chloropropyl)pyridine-3-carboxamide
CID 17164667
2-[2-(pyridine-3-carbonylamino)ethyldisulfanyl]ethyl nitrate
CID 11558535
N-(3-pyrrol-1-ylpropyl)pyridine-3-carboxamide
CID 90500651
N-(5-iodopentyl)pyridine-3-carboxamide
CID 107322434
2-imidazo[1,2-a]pyridin-5-ylsulfanyl-N,N-dimethylethanamine
CID 76849265
N-(3,3,3-trifluoropropyl)pyridine-3-carboxamide
CID 91045435
N-[2-[(4-chlorobenzoyl)amino]ethyl]pyridine-3-carboxamide
CID 3975684
N-[2-[(4-aminobenzoyl)amino]ethyl]pyridine-3-carboxamide
CID 108924536
2-imidazo[1,2-a]pyridin-5-ylsulfanylethyl N-methyl-N-pyridin-4-ylcarbamate
CID 67794030
N-[3-[(4-pyrrol-1-ylbenzoyl)amino]propyl]pyridine-3-carboxamide
CID 108926632
N-[2-(1-benzylimidazol-2-yl)ethyl]pyridine-3-carboxamide
CID 134039644
N-[2-(propan-2-ylamino)ethyl]pyridine-3-carboxamide
CID 4235481

Frequently Asked Questions

What is the IUPAC name of N-(2-imidazo[1,2-a]pyridin-5-ylsulfanylethyl)pyridine-3-carboxamide?
The IUPAC name of N-(2-imidazo[1,2-a]pyridin-5-ylsulfanylethyl)pyridine-3-carboxamide (CID 23362816) is N-(2-imidazo[1,2-a]pyridin-5-ylsulfanylethyl)pyridine-3-carboxamide.
What is the SMILES notation for N-(2-imidazo[1,2-a]pyridin-5-ylsulfanylethyl)pyridine-3-carboxamide?
The canonical SMILES for N-(2-imidazo[1,2-a]pyridin-5-ylsulfanylethyl)pyridine-3-carboxamide is O=C(NCCSc1cccc2nccn12)c1cccnc1.
What is the InChIKey of N-(2-imidazo[1,2-a]pyridin-5-ylsulfanylethyl)pyridine-3-carboxamide?
The InChIKey is FUIOROVXECCSCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4OS/c20-15(12-3-2-6-16-11-12)18-8-10-21-14-5-1-4-13-17-7-9-19(13)14/h1-7,9,11H,8,10H2,(H,18,20).
What are the key properties of N-(2-imidazo[1,2-a]pyridin-5-ylsulfanylethyl)pyridine-3-carboxamide?
N-(2-imidazo[1,2-a]pyridin-5-ylsulfanylethyl)pyridine-3-carboxamide has a molecular weight of 298.37 g/mol, XLogP of 2.25, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-imidazo[1,2-a]pyridin-5-ylsulfanylethyl)pyridine-3-carboxamide is sourced from PubChem (CID 23362816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).