(2-methylimidazo[1,2-a]pyridin-3-yl)-[3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]methanone

C20H19N5O2S — CID 121068888

IUPAC(2-methylimidazo[1,2-a]pyridin-3-yl)-[3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]methanone
SMILESCc1nc2ccccn2c1C(=O)N1CCCC(c2nnc(-c3cccs3)o2)C1
InChIInChI=1S/C20H19N5O2S/c1-13-17(25-10-3-2-8-16(25)21-13)20(26)24-9-4-6-14(12-24)18-22-23-19(27-18)15-7-5-11-28-15/h2-3,5,7-8,10-11,14H,4,6,9,12H2,1H3
InChIKeyCOGGXLYKGGZVRW-UHFFFAOYSA-N
MW393.47 g/mol
LogP3.77
Rot. Bonds3

About (2-methylimidazo[1,2-a]pyridin-3-yl)-[3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]methanone

(2-methylimidazo[1,2-a]pyridin-3-yl)-[3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]methanone (PubChem CID 121068888) has the molecular formula C20H19N5O2S and a molecular weight of 393.47 g/mol. Its IUPAC name is (2-methylimidazo[1,2-a]pyridin-3-yl)-[3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]methanone.

Molecular Properties

Compound Name(2-methylimidazo[1,2-a]pyridin-3-yl)-[3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]methanone
PubChem CID121068888
Molecular FormulaC20H19N5O2S
Molecular Weight393.47 g/mol
Exact Mass393.13
IUPAC Name(2-methylimidazo[1,2-a]pyridin-3-yl)-[3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]methanone
SMILESCc1nc2ccccn2c1C(=O)N1CCCC(c2nnc(-c3cccs3)o2)C1
InChIInChI=1S/C20H19N5O2S/c1-13-17(25-10-3-2-8-16(25)21-13)20(26)24-9-4-6-14(12-24)18-22-23-19(27-18)15-7-5-11-28-15/h2-3,5,7-8,10-11,14H,4,6,9,12H2,1H3
InChIKeyCOGGXLYKGGZVRW-UHFFFAOYSA-N
XLogP3.77
TPSA76.53 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.47
LogP ≤ 53.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of (2-methylimidazo[1,2-a]pyridin-3-yl)-[3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]methanone?
The IUPAC name of (2-methylimidazo[1,2-a]pyridin-3-yl)-[3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]methanone (CID 121068888) is (2-methylimidazo[1,2-a]pyridin-3-yl)-[3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]methanone.
What is the SMILES notation for (2-methylimidazo[1,2-a]pyridin-3-yl)-[3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]methanone?
The canonical SMILES for (2-methylimidazo[1,2-a]pyridin-3-yl)-[3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]methanone is Cc1nc2ccccn2c1C(=O)N1CCCC(c2nnc(-c3cccs3)o2)C1.
What is the InChIKey of (2-methylimidazo[1,2-a]pyridin-3-yl)-[3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]methanone?
The InChIKey is COGGXLYKGGZVRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N5O2S/c1-13-17(25-10-3-2-8-16(25)21-13)20(26)24-9-4-6-14(12-24)18-22-23-19(27-18)15-7-5-11-28-15/h2-3,5,7-8,10-11,14H,4,6,9,12H2,1H3.
What are the key properties of (2-methylimidazo[1,2-a]pyridin-3-yl)-[3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]methanone?
(2-methylimidazo[1,2-a]pyridin-3-yl)-[3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]methanone has a molecular weight of 393.47 g/mol, XLogP of 3.77, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylimidazo[1,2-a]pyridin-3-yl)-[3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]methanone is sourced from PubChem (CID 121068888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).