3-(2-ethylpyrrolidin-1-yl)sulfonylimidazo[1,2-a]pyridin-2-amine

C13H18N4O2S — CID 62162787

IUPAC3-(2-ethylpyrrolidin-1-yl)sulfonylimidazo[1,2-a]pyridin-2-amine
SMILESCCC1CCCN1S(=O)(=O)c1c(N)nc2ccccn12
InChIInChI=1S/C13H18N4O2S/c1-2-10-6-5-9-17(10)20(18,19)13-12(14)15-11-7-3-4-8-16(11)13/h3-4,7-8,10H,2,5-6,9,14H2,1H3
InChIKeyUGOPLXJDHVQAID-UHFFFAOYSA-N
MW294.38 g/mol
LogP1.48
Rot. Bonds3

About 3-(2-ethylpyrrolidin-1-yl)sulfonylimidazo[1,2-a]pyridin-2-amine

3-(2-ethylpyrrolidin-1-yl)sulfonylimidazo[1,2-a]pyridin-2-amine (PubChem CID 62162787) has the molecular formula C13H18N4O2S and a molecular weight of 294.38 g/mol. Its IUPAC name is 3-(2-ethylpyrrolidin-1-yl)sulfonylimidazo[1,2-a]pyridin-2-amine.

Molecular Properties

Compound Name3-(2-ethylpyrrolidin-1-yl)sulfonylimidazo[1,2-a]pyridin-2-amine
PubChem CID62162787
Molecular FormulaC13H18N4O2S
Molecular Weight294.38 g/mol
Exact Mass294.12
IUPAC Name3-(2-ethylpyrrolidin-1-yl)sulfonylimidazo[1,2-a]pyridin-2-amine
SMILESCCC1CCCN1S(=O)(=O)c1c(N)nc2ccccn12
InChIInChI=1S/C13H18N4O2S/c1-2-10-6-5-9-17(10)20(18,19)13-12(14)15-11-7-3-4-8-16(11)13/h3-4,7-8,10H,2,5-6,9,14H2,1H3
InChIKeyUGOPLXJDHVQAID-UHFFFAOYSA-N
XLogP1.48
TPSA80.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.38
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-(2-ethylpyrrolidin-1-yl)sulfonylimidazo[1,2-a]pyridin-2-amine?
The IUPAC name of 3-(2-ethylpyrrolidin-1-yl)sulfonylimidazo[1,2-a]pyridin-2-amine (CID 62162787) is 3-(2-ethylpyrrolidin-1-yl)sulfonylimidazo[1,2-a]pyridin-2-amine.
What is the SMILES notation for 3-(2-ethylpyrrolidin-1-yl)sulfonylimidazo[1,2-a]pyridin-2-amine?
The canonical SMILES for 3-(2-ethylpyrrolidin-1-yl)sulfonylimidazo[1,2-a]pyridin-2-amine is CCC1CCCN1S(=O)(=O)c1c(N)nc2ccccn12.
What is the InChIKey of 3-(2-ethylpyrrolidin-1-yl)sulfonylimidazo[1,2-a]pyridin-2-amine?
The InChIKey is UGOPLXJDHVQAID-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4O2S/c1-2-10-6-5-9-17(10)20(18,19)13-12(14)15-11-7-3-4-8-16(11)13/h3-4,7-8,10H,2,5-6,9,14H2,1H3.
What are the key properties of 3-(2-ethylpyrrolidin-1-yl)sulfonylimidazo[1,2-a]pyridin-2-amine?
3-(2-ethylpyrrolidin-1-yl)sulfonylimidazo[1,2-a]pyridin-2-amine has a molecular weight of 294.38 g/mol, XLogP of 1.48, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-ethylpyrrolidin-1-yl)sulfonylimidazo[1,2-a]pyridin-2-amine is sourced from PubChem (CID 62162787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).