3-(7-methylimidazo[1,2-a]pyridin-2-yl)-7-piperazin-1-ylpyrano[3,2-c]pyridin-2-one

C20H19N5O2 — CID 71731526

IUPAC3-(7-methylimidazo[1,2-a]pyridin-2-yl)-7-piperazin-1-ylpyrano[3,2-c]pyridin-2-one
SMILESCc1ccn2cc(-c3cc4cnc(N5CCNCC5)cc4oc3=O)nc2c1
InChIInChI=1S/C20H19N5O2/c1-13-2-5-25-12-16(23-19(25)8-13)15-9-14-11-22-18(10-17(14)27-20(15)26)24-6-3-21-4-7-24/h2,5,8-12,21H,3-4,6-7H2,1H3
InChIKeyYQTGGYHBSMQEJL-UHFFFAOYSA-N
MW361.41 g/mol
LogP2.22
Rot. Bonds2

About 3-(7-methylimidazo[1,2-a]pyridin-2-yl)-7-piperazin-1-ylpyrano[3,2-c]pyridin-2-one

3-(7-methylimidazo[1,2-a]pyridin-2-yl)-7-piperazin-1-ylpyrano[3,2-c]pyridin-2-one (PubChem CID 71731526) has the molecular formula C20H19N5O2 and a molecular weight of 361.41 g/mol. Its IUPAC name is 3-(7-methylimidazo[1,2-a]pyridin-2-yl)-7-piperazin-1-ylpyrano[3,2-c]pyridin-2-one.

Molecular Properties

Compound Name3-(7-methylimidazo[1,2-a]pyridin-2-yl)-7-piperazin-1-ylpyrano[3,2-c]pyridin-2-one
PubChem CID71731526
Molecular FormulaC20H19N5O2
Molecular Weight361.41 g/mol
Exact Mass361.15
IUPAC Name3-(7-methylimidazo[1,2-a]pyridin-2-yl)-7-piperazin-1-ylpyrano[3,2-c]pyridin-2-one
SMILESCc1ccn2cc(-c3cc4cnc(N5CCNCC5)cc4oc3=O)nc2c1
InChIInChI=1S/C20H19N5O2/c1-13-2-5-25-12-16(23-19(25)8-13)15-9-14-11-22-18(10-17(14)27-20(15)26)24-6-3-21-4-7-24/h2,5,8-12,21H,3-4,6-7H2,1H3
InChIKeyYQTGGYHBSMQEJL-UHFFFAOYSA-N
XLogP2.22
TPSA75.67 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.41
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 3-(7-methylimidazo[1,2-a]pyridin-2-yl)-7-piperazin-1-ylpyrano[3,2-c]pyridin-2-one?
The IUPAC name of 3-(7-methylimidazo[1,2-a]pyridin-2-yl)-7-piperazin-1-ylpyrano[3,2-c]pyridin-2-one (CID 71731526) is 3-(7-methylimidazo[1,2-a]pyridin-2-yl)-7-piperazin-1-ylpyrano[3,2-c]pyridin-2-one.
What is the SMILES notation for 3-(7-methylimidazo[1,2-a]pyridin-2-yl)-7-piperazin-1-ylpyrano[3,2-c]pyridin-2-one?
The canonical SMILES for 3-(7-methylimidazo[1,2-a]pyridin-2-yl)-7-piperazin-1-ylpyrano[3,2-c]pyridin-2-one is Cc1ccn2cc(-c3cc4cnc(N5CCNCC5)cc4oc3=O)nc2c1.
What is the InChIKey of 3-(7-methylimidazo[1,2-a]pyridin-2-yl)-7-piperazin-1-ylpyrano[3,2-c]pyridin-2-one?
The InChIKey is YQTGGYHBSMQEJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N5O2/c1-13-2-5-25-12-16(23-19(25)8-13)15-9-14-11-22-18(10-17(14)27-20(15)26)24-6-3-21-4-7-24/h2,5,8-12,21H,3-4,6-7H2,1H3.
What are the key properties of 3-(7-methylimidazo[1,2-a]pyridin-2-yl)-7-piperazin-1-ylpyrano[3,2-c]pyridin-2-one?
3-(7-methylimidazo[1,2-a]pyridin-2-yl)-7-piperazin-1-ylpyrano[3,2-c]pyridin-2-one has a molecular weight of 361.41 g/mol, XLogP of 2.22, 2 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(7-methylimidazo[1,2-a]pyridin-2-yl)-7-piperazin-1-ylpyrano[3,2-c]pyridin-2-one is sourced from PubChem (CID 71731526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).