2-(2-methylimidazo[1,2-a]pyridin-3-yl)-1-[3-(1H-pyrazol-5-yl)pyrrolidin-1-yl]ethanone

C17H19N5O — CID 127247124

IUPAC2-(2-methylimidazo[1,2-a]pyridin-3-yl)-1-[3-(1H-pyrazol-5-yl)pyrrolidin-1-yl]ethanone
SMILESCc1nc2ccccn2c1CC(=O)N1CCC(c2ccn[nH]2)C1
InChIInChI=1S/C17H19N5O/c1-12-15(22-8-3-2-4-16(22)19-12)10-17(23)21-9-6-13(11-21)14-5-7-18-20-14/h2-5,7-8,13H,6,9-11H2,1H3,(H,18,20)
InChIKeyTZHVANMVXGPCGE-UHFFFAOYSA-N
MW309.37 g/mol
LogP1.92
Rot. Bonds3

About 2-(2-methylimidazo[1,2-a]pyridin-3-yl)-1-[3-(1H-pyrazol-5-yl)pyrrolidin-1-yl]ethanone

2-(2-methylimidazo[1,2-a]pyridin-3-yl)-1-[3-(1H-pyrazol-5-yl)pyrrolidin-1-yl]ethanone (PubChem CID 127247124) has the molecular formula C17H19N5O and a molecular weight of 309.37 g/mol. Its IUPAC name is 2-(2-methylimidazo[1,2-a]pyridin-3-yl)-1-[3-(1H-pyrazol-5-yl)pyrrolidin-1-yl]ethanone.

Molecular Properties

Compound Name2-(2-methylimidazo[1,2-a]pyridin-3-yl)-1-[3-(1H-pyrazol-5-yl)pyrrolidin-1-yl]ethanone
PubChem CID127247124
Molecular FormulaC17H19N5O
Molecular Weight309.37 g/mol
Exact Mass309.16
IUPAC Name2-(2-methylimidazo[1,2-a]pyridin-3-yl)-1-[3-(1H-pyrazol-5-yl)pyrrolidin-1-yl]ethanone
SMILESCc1nc2ccccn2c1CC(=O)N1CCC(c2ccn[nH]2)C1
InChIInChI=1S/C17H19N5O/c1-12-15(22-8-3-2-4-16(22)19-12)10-17(23)21-9-6-13(11-21)14-5-7-18-20-14/h2-5,7-8,13H,6,9-11H2,1H3,(H,18,20)
InChIKeyTZHVANMVXGPCGE-UHFFFAOYSA-N
XLogP1.92
TPSA66.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.37
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methylimidazo[1,2-a]pyridin-3-yl)-1-[3-(1H-pyrazol-5-yl)pyrrolidin-1-yl]ethanone?
The IUPAC name of 2-(2-methylimidazo[1,2-a]pyridin-3-yl)-1-[3-(1H-pyrazol-5-yl)pyrrolidin-1-yl]ethanone (CID 127247124) is 2-(2-methylimidazo[1,2-a]pyridin-3-yl)-1-[3-(1H-pyrazol-5-yl)pyrrolidin-1-yl]ethanone.
What is the SMILES notation for 2-(2-methylimidazo[1,2-a]pyridin-3-yl)-1-[3-(1H-pyrazol-5-yl)pyrrolidin-1-yl]ethanone?
The canonical SMILES for 2-(2-methylimidazo[1,2-a]pyridin-3-yl)-1-[3-(1H-pyrazol-5-yl)pyrrolidin-1-yl]ethanone is Cc1nc2ccccn2c1CC(=O)N1CCC(c2ccn[nH]2)C1.
What is the InChIKey of 2-(2-methylimidazo[1,2-a]pyridin-3-yl)-1-[3-(1H-pyrazol-5-yl)pyrrolidin-1-yl]ethanone?
The InChIKey is TZHVANMVXGPCGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N5O/c1-12-15(22-8-3-2-4-16(22)19-12)10-17(23)21-9-6-13(11-21)14-5-7-18-20-14/h2-5,7-8,13H,6,9-11H2,1H3,(H,18,20).
What are the key properties of 2-(2-methylimidazo[1,2-a]pyridin-3-yl)-1-[3-(1H-pyrazol-5-yl)pyrrolidin-1-yl]ethanone?
2-(2-methylimidazo[1,2-a]pyridin-3-yl)-1-[3-(1H-pyrazol-5-yl)pyrrolidin-1-yl]ethanone has a molecular weight of 309.37 g/mol, XLogP of 1.92, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylimidazo[1,2-a]pyridin-3-yl)-1-[3-(1H-pyrazol-5-yl)pyrrolidin-1-yl]ethanone is sourced from PubChem (CID 127247124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).