2-amino-N-(1-ethylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-sulfonamide

C12H14N6O2S — CID 62147505

IUPAC2-amino-N-(1-ethylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-sulfonamide
SMILESCCn1cc(NS(=O)(=O)c2c(N)nc3ccccn23)cn1
InChIInChI=1S/C12H14N6O2S/c1-2-17-8-9(7-14-17)16-21(19,20)12-11(13)15-10-5-3-4-6-18(10)12/h3-8,16H,2,13H2,1H3
InChIKeyBJVVNIBGTUOPER-UHFFFAOYSA-N
MW306.35 g/mol
LogP0.93
Rot. Bonds4

About 2-amino-N-(1-ethylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-sulfonamide

2-amino-N-(1-ethylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-sulfonamide (PubChem CID 62147505) has the molecular formula C12H14N6O2S and a molecular weight of 306.35 g/mol. Its IUPAC name is 2-amino-N-(1-ethylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-sulfonamide.

Molecular Properties

Compound Name2-amino-N-(1-ethylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-sulfonamide
PubChem CID62147505
Molecular FormulaC12H14N6O2S
Molecular Weight306.35 g/mol
Exact Mass306.09
IUPAC Name2-amino-N-(1-ethylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-sulfonamide
SMILESCCn1cc(NS(=O)(=O)c2c(N)nc3ccccn23)cn1
InChIInChI=1S/C12H14N6O2S/c1-2-17-8-9(7-14-17)16-21(19,20)12-11(13)15-10-5-3-4-6-18(10)12/h3-8,16H,2,13H2,1H3
InChIKeyBJVVNIBGTUOPER-UHFFFAOYSA-N
XLogP0.93
TPSA107.31 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.35
LogP ≤ 50.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(1-ethylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-sulfonamide?
The IUPAC name of 2-amino-N-(1-ethylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-sulfonamide (CID 62147505) is 2-amino-N-(1-ethylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-sulfonamide.
What is the SMILES notation for 2-amino-N-(1-ethylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-sulfonamide?
The canonical SMILES for 2-amino-N-(1-ethylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-sulfonamide is CCn1cc(NS(=O)(=O)c2c(N)nc3ccccn23)cn1.
What is the InChIKey of 2-amino-N-(1-ethylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-sulfonamide?
The InChIKey is BJVVNIBGTUOPER-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N6O2S/c1-2-17-8-9(7-14-17)16-21(19,20)12-11(13)15-10-5-3-4-6-18(10)12/h3-8,16H,2,13H2,1H3.
What are the key properties of 2-amino-N-(1-ethylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-sulfonamide?
2-amino-N-(1-ethylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-sulfonamide has a molecular weight of 306.35 g/mol, XLogP of 0.93, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(1-ethylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-sulfonamide is sourced from PubChem (CID 62147505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).