X5N

(6P)-6-[(4R)-imidazo[1,2-a]pyridin-3-yl]-4-(piperidin-4-yl)-2H-pyrido[3,2-b][1,4]oxazin-3(4H)-one

Created:2023-10-23
Last modified:  2024-10-23

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Chemical Details

Formal Charge0
Atom Count45
Chiral Atom Count0
Bond Count49
Aromatic Bond Count16
2D diagram of X5N

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Chemical Component Summary

Name(6P)-6-[(4R)-imidazo[1,2-a]pyridin-3-yl]-4-(piperidin-4-yl)-2H-pyrido[3,2-b][1,4]oxazin-3(4H)-one
Systematic Name (OpenEye OEToolkits)6-imidazo[1,2-a]pyridin-3-yl-4-piperidin-4-yl-pyrido[3,2-b][1,4]oxazin-3-one
FormulaC19 H19 N5 O2
Molecular Weight349.386
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01O=C1COc2ccc(nc2N1C1CCNCC1)c1cnc2ccccn21
SMILESCACTVS3.385O=C1COc2ccc(nc2N1C3CCNCC3)c4cnc5ccccn45
SMILESOpenEye OEToolkits2.0.7c1ccn2c(c1)ncc2c3ccc4c(n3)N(C(=O)CO4)C5CCNCC5
Canonical SMILESCACTVS3.385 O=C1COc2ccc(nc2N1C3CCNCC3)c4cnc5ccccn45
Canonical SMILESOpenEye OEToolkits2.0.7 c1ccn2c(c1)ncc2c3ccc4c(n3)N(C(=O)CO4)C5CCNCC5
InChIInChI1.06 InChI=1S/C19H19N5O2/c25-18-12-26-16-5-4-14(15-11-21-17-3-1-2-10-23(15)17)22-19(16)24(18)13-6-8-20-9-7-13/h1-5,10-11,13,20H,6-9,12H2
InChIKeyInChI1.06 SQOLXUGRJNPDOA-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 172055182