5-(2-amino-5-methoxyimidazo[4,5-b]pyridin-3-yl)piperidin-2-one

C12H15N5O2 — CID 115322412

IUPAC5-(2-amino-5-methoxyimidazo[4,5-b]pyridin-3-yl)piperidin-2-one
SMILESCOc1ccc2nc(N)n(C3CCC(=O)NC3)c2n1
InChIInChI=1S/C12H15N5O2/c1-19-10-5-3-8-11(16-10)17(12(13)15-8)7-2-4-9(18)14-6-7/h3,5,7H,2,4,6H2,1H3,(H2,13,15)(H,14,18)
InChIKeyIOPLAOWBCPWGLY-UHFFFAOYSA-N
MW261.28 g/mol
LogP0.47
Rot. Bonds2

About 5-(2-amino-5-methoxyimidazo[4,5-b]pyridin-3-yl)piperidin-2-one

5-(2-amino-5-methoxyimidazo[4,5-b]pyridin-3-yl)piperidin-2-one (PubChem CID 115322412) has the molecular formula C12H15N5O2 and a molecular weight of 261.28 g/mol. Its IUPAC name is 5-(2-amino-5-methoxyimidazo[4,5-b]pyridin-3-yl)piperidin-2-one.

Molecular Properties

Compound Name5-(2-amino-5-methoxyimidazo[4,5-b]pyridin-3-yl)piperidin-2-one
PubChem CID115322412
Molecular FormulaC12H15N5O2
Molecular Weight261.28 g/mol
Exact Mass261.12
IUPAC Name5-(2-amino-5-methoxyimidazo[4,5-b]pyridin-3-yl)piperidin-2-one
SMILESCOc1ccc2nc(N)n(C3CCC(=O)NC3)c2n1
InChIInChI=1S/C12H15N5O2/c1-19-10-5-3-8-11(16-10)17(12(13)15-8)7-2-4-9(18)14-6-7/h3,5,7H,2,4,6H2,1H3,(H2,13,15)(H,14,18)
InChIKeyIOPLAOWBCPWGLY-UHFFFAOYSA-N
XLogP0.47
TPSA95.06 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.28
LogP ≤ 50.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-(2-amino-5-methoxyimidazo[4,5-b]pyridin-3-yl)piperidin-2-one?
The IUPAC name of 5-(2-amino-5-methoxyimidazo[4,5-b]pyridin-3-yl)piperidin-2-one (CID 115322412) is 5-(2-amino-5-methoxyimidazo[4,5-b]pyridin-3-yl)piperidin-2-one.
What is the SMILES notation for 5-(2-amino-5-methoxyimidazo[4,5-b]pyridin-3-yl)piperidin-2-one?
The canonical SMILES for 5-(2-amino-5-methoxyimidazo[4,5-b]pyridin-3-yl)piperidin-2-one is COc1ccc2nc(N)n(C3CCC(=O)NC3)c2n1.
What is the InChIKey of 5-(2-amino-5-methoxyimidazo[4,5-b]pyridin-3-yl)piperidin-2-one?
The InChIKey is IOPLAOWBCPWGLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N5O2/c1-19-10-5-3-8-11(16-10)17(12(13)15-8)7-2-4-9(18)14-6-7/h3,5,7H,2,4,6H2,1H3,(H2,13,15)(H,14,18).
What are the key properties of 5-(2-amino-5-methoxyimidazo[4,5-b]pyridin-3-yl)piperidin-2-one?
5-(2-amino-5-methoxyimidazo[4,5-b]pyridin-3-yl)piperidin-2-one has a molecular weight of 261.28 g/mol, XLogP of 0.47, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-amino-5-methoxyimidazo[4,5-b]pyridin-3-yl)piperidin-2-one is sourced from PubChem (CID 115322412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).