N-[2-(4-sulfamoylphenyl)ethyl]imidazo[1,2-a]pyridine-6-carboxamide

C16H16N4O3S — CID 110703991

IUPACN-[2-(4-sulfamoylphenyl)ethyl]imidazo[1,2-a]pyridine-6-carboxamide
SMILESNS(=O)(=O)c1ccc(CCNC(=O)c2ccc3nccn3c2)cc1
InChIInChI=1S/C16H16N4O3S/c17-24(22,23)14-4-1-12(2-5-14)7-8-19-16(21)13-3-6-15-18-9-10-20(15)11-13/h1-6,9-11H,7-8H2,(H,19,21)(H2,17,22,23)
InChIKeyQKIBKMJMFXTVLS-UHFFFAOYSA-N
MW344.40 g/mol
LogP0.95
Rot. Bonds5

About N-[2-(4-sulfamoylphenyl)ethyl]imidazo[1,2-a]pyridine-6-carboxamide

N-[2-(4-sulfamoylphenyl)ethyl]imidazo[1,2-a]pyridine-6-carboxamide (PubChem CID 110703991) has the molecular formula C16H16N4O3S and a molecular weight of 344.40 g/mol. Its IUPAC name is N-[2-(4-sulfamoylphenyl)ethyl]imidazo[1,2-a]pyridine-6-carboxamide.

Molecular Properties

Compound NameN-[2-(4-sulfamoylphenyl)ethyl]imidazo[1,2-a]pyridine-6-carboxamide
PubChem CID110703991
Molecular FormulaC16H16N4O3S
Molecular Weight344.40 g/mol
Exact Mass344.09
IUPAC NameN-[2-(4-sulfamoylphenyl)ethyl]imidazo[1,2-a]pyridine-6-carboxamide
SMILESNS(=O)(=O)c1ccc(CCNC(=O)c2ccc3nccn3c2)cc1
InChIInChI=1S/C16H16N4O3S/c17-24(22,23)14-4-1-12(2-5-14)7-8-19-16(21)13-3-6-15-18-9-10-20(15)11-13/h1-6,9-11H,7-8H2,(H,19,21)(H2,17,22,23)
InChIKeyQKIBKMJMFXTVLS-UHFFFAOYSA-N
XLogP0.95
TPSA106.56 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.40
LogP ≤ 50.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[2-(4-sulfamoylphenyl)ethyl]imidazo[1,2-a]pyridine-6-carboxamide?
The IUPAC name of N-[2-(4-sulfamoylphenyl)ethyl]imidazo[1,2-a]pyridine-6-carboxamide (CID 110703991) is N-[2-(4-sulfamoylphenyl)ethyl]imidazo[1,2-a]pyridine-6-carboxamide.
What is the SMILES notation for N-[2-(4-sulfamoylphenyl)ethyl]imidazo[1,2-a]pyridine-6-carboxamide?
The canonical SMILES for N-[2-(4-sulfamoylphenyl)ethyl]imidazo[1,2-a]pyridine-6-carboxamide is NS(=O)(=O)c1ccc(CCNC(=O)c2ccc3nccn3c2)cc1.
What is the InChIKey of N-[2-(4-sulfamoylphenyl)ethyl]imidazo[1,2-a]pyridine-6-carboxamide?
The InChIKey is QKIBKMJMFXTVLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N4O3S/c17-24(22,23)14-4-1-12(2-5-14)7-8-19-16(21)13-3-6-15-18-9-10-20(15)11-13/h1-6,9-11H,7-8H2,(H,19,21)(H2,17,22,23).
What are the key properties of N-[2-(4-sulfamoylphenyl)ethyl]imidazo[1,2-a]pyridine-6-carboxamide?
N-[2-(4-sulfamoylphenyl)ethyl]imidazo[1,2-a]pyridine-6-carboxamide has a molecular weight of 344.40 g/mol, XLogP of 0.95, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-sulfamoylphenyl)ethyl]imidazo[1,2-a]pyridine-6-carboxamide is sourced from PubChem (CID 110703991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).