2-amino-N-(thiophen-3-ylmethyl)imidazo[1,2-a]pyridine-3-sulfonamide

C12H12N4O2S2 — CID 63244564

IUPAC2-amino-N-(thiophen-3-ylmethyl)imidazo[1,2-a]pyridine-3-sulfonamide
SMILESNc1nc2ccccn2c1S(=O)(=O)NCc1ccsc1
InChIInChI=1S/C12H12N4O2S2/c13-11-12(16-5-2-1-3-10(16)15-11)20(17,18)14-7-9-4-6-19-8-9/h1-6,8,14H,7,13H2
InChIKeyMHHKJIBFZJRJKP-UHFFFAOYSA-N
MW308.39 g/mol
LogP1.46
Rot. Bonds4

About 2-amino-N-(thiophen-3-ylmethyl)imidazo[1,2-a]pyridine-3-sulfonamide

2-amino-N-(thiophen-3-ylmethyl)imidazo[1,2-a]pyridine-3-sulfonamide (PubChem CID 63244564) has the molecular formula C12H12N4O2S2 and a molecular weight of 308.39 g/mol. Its IUPAC name is 2-amino-N-(thiophen-3-ylmethyl)imidazo[1,2-a]pyridine-3-sulfonamide.

Molecular Properties

Compound Name2-amino-N-(thiophen-3-ylmethyl)imidazo[1,2-a]pyridine-3-sulfonamide
PubChem CID63244564
Molecular FormulaC12H12N4O2S2
Molecular Weight308.39 g/mol
Exact Mass308.04
IUPAC Name2-amino-N-(thiophen-3-ylmethyl)imidazo[1,2-a]pyridine-3-sulfonamide
SMILESNc1nc2ccccn2c1S(=O)(=O)NCc1ccsc1
InChIInChI=1S/C12H12N4O2S2/c13-11-12(16-5-2-1-3-10(16)15-11)20(17,18)14-7-9-4-6-19-8-9/h1-6,8,14H,7,13H2
InChIKeyMHHKJIBFZJRJKP-UHFFFAOYSA-N
XLogP1.46
TPSA89.49 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.39
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(thiophen-3-ylmethyl)imidazo[1,2-a]pyridine-3-sulfonamide?
The IUPAC name of 2-amino-N-(thiophen-3-ylmethyl)imidazo[1,2-a]pyridine-3-sulfonamide (CID 63244564) is 2-amino-N-(thiophen-3-ylmethyl)imidazo[1,2-a]pyridine-3-sulfonamide.
What is the SMILES notation for 2-amino-N-(thiophen-3-ylmethyl)imidazo[1,2-a]pyridine-3-sulfonamide?
The canonical SMILES for 2-amino-N-(thiophen-3-ylmethyl)imidazo[1,2-a]pyridine-3-sulfonamide is Nc1nc2ccccn2c1S(=O)(=O)NCc1ccsc1.
What is the InChIKey of 2-amino-N-(thiophen-3-ylmethyl)imidazo[1,2-a]pyridine-3-sulfonamide?
The InChIKey is MHHKJIBFZJRJKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N4O2S2/c13-11-12(16-5-2-1-3-10(16)15-11)20(17,18)14-7-9-4-6-19-8-9/h1-6,8,14H,7,13H2.
What are the key properties of 2-amino-N-(thiophen-3-ylmethyl)imidazo[1,2-a]pyridine-3-sulfonamide?
2-amino-N-(thiophen-3-ylmethyl)imidazo[1,2-a]pyridine-3-sulfonamide has a molecular weight of 308.39 g/mol, XLogP of 1.46, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(thiophen-3-ylmethyl)imidazo[1,2-a]pyridine-3-sulfonamide is sourced from PubChem (CID 63244564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).