5-methyl-3-[4-(7-methylimidazo[1,2-a]pyridin-2-yl)-4-phenylpiperidin-1-yl]-1,2,4-oxadiazole

C22H23N5O — CID 164698549

IUPAC5-methyl-3-[4-(7-methylimidazo[1,2-a]pyridin-2-yl)-4-phenylpiperidin-1-yl]-1,2,4-oxadiazole
SMILESCc1ccn2cc(C3(c4ccccc4)CCN(c4noc(C)n4)CC3)nc2c1
InChIInChI=1S/C22H23N5O/c1-16-8-11-27-15-19(24-20(27)14-16)22(18-6-4-3-5-7-18)9-12-26(13-10-22)21-23-17(2)28-25-21/h3-8,11,14-15H,9-10,12-13H2,1-2H3
InChIKeyZEZJSZJIQUNWNB-UHFFFAOYSA-N
MW373.46 g/mol
LogP3.92
Rot. Bonds3

About 5-methyl-3-[4-(7-methylimidazo[1,2-a]pyridin-2-yl)-4-phenylpiperidin-1-yl]-1,2,4-oxadiazole

5-methyl-3-[4-(7-methylimidazo[1,2-a]pyridin-2-yl)-4-phenylpiperidin-1-yl]-1,2,4-oxadiazole (PubChem CID 164698549) has the molecular formula C22H23N5O and a molecular weight of 373.46 g/mol. Its IUPAC name is 5-methyl-3-[4-(7-methylimidazo[1,2-a]pyridin-2-yl)-4-phenylpiperidin-1-yl]-1,2,4-oxadiazole.

Molecular Properties

Compound Name5-methyl-3-[4-(7-methylimidazo[1,2-a]pyridin-2-yl)-4-phenylpiperidin-1-yl]-1,2,4-oxadiazole
PubChem CID164698549
Molecular FormulaC22H23N5O
Molecular Weight373.46 g/mol
Exact Mass373.19
IUPAC Name5-methyl-3-[4-(7-methylimidazo[1,2-a]pyridin-2-yl)-4-phenylpiperidin-1-yl]-1,2,4-oxadiazole
SMILESCc1ccn2cc(C3(c4ccccc4)CCN(c4noc(C)n4)CC3)nc2c1
InChIInChI=1S/C22H23N5O/c1-16-8-11-27-15-19(24-20(27)14-16)22(18-6-4-3-5-7-18)9-12-26(13-10-22)21-23-17(2)28-25-21/h3-8,11,14-15H,9-10,12-13H2,1-2H3
InChIKeyZEZJSZJIQUNWNB-UHFFFAOYSA-N
XLogP3.92
TPSA59.46 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.46
LogP ≤ 53.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-3-[4-(7-methylimidazo[1,2-a]pyridin-2-yl)-4-phenylpiperidin-1-yl]-1,2,4-oxadiazole?
The IUPAC name of 5-methyl-3-[4-(7-methylimidazo[1,2-a]pyridin-2-yl)-4-phenylpiperidin-1-yl]-1,2,4-oxadiazole (CID 164698549) is 5-methyl-3-[4-(7-methylimidazo[1,2-a]pyridin-2-yl)-4-phenylpiperidin-1-yl]-1,2,4-oxadiazole.
What is the SMILES notation for 5-methyl-3-[4-(7-methylimidazo[1,2-a]pyridin-2-yl)-4-phenylpiperidin-1-yl]-1,2,4-oxadiazole?
The canonical SMILES for 5-methyl-3-[4-(7-methylimidazo[1,2-a]pyridin-2-yl)-4-phenylpiperidin-1-yl]-1,2,4-oxadiazole is Cc1ccn2cc(C3(c4ccccc4)CCN(c4noc(C)n4)CC3)nc2c1.
What is the InChIKey of 5-methyl-3-[4-(7-methylimidazo[1,2-a]pyridin-2-yl)-4-phenylpiperidin-1-yl]-1,2,4-oxadiazole?
The InChIKey is ZEZJSZJIQUNWNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N5O/c1-16-8-11-27-15-19(24-20(27)14-16)22(18-6-4-3-5-7-18)9-12-26(13-10-22)21-23-17(2)28-25-21/h3-8,11,14-15H,9-10,12-13H2,1-2H3.
What are the key properties of 5-methyl-3-[4-(7-methylimidazo[1,2-a]pyridin-2-yl)-4-phenylpiperidin-1-yl]-1,2,4-oxadiazole?
5-methyl-3-[4-(7-methylimidazo[1,2-a]pyridin-2-yl)-4-phenylpiperidin-1-yl]-1,2,4-oxadiazole has a molecular weight of 373.46 g/mol, XLogP of 3.92, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-3-[4-(7-methylimidazo[1,2-a]pyridin-2-yl)-4-phenylpiperidin-1-yl]-1,2,4-oxadiazole is sourced from PubChem (CID 164698549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).