4-(2-amino-6-methylimidazo[4,5-b]pyridin-3-yl)pyrrolidin-2-one

C11H13N5O — CID 106186692

IUPAC4-(2-amino-6-methylimidazo[4,5-b]pyridin-3-yl)pyrrolidin-2-one
SMILESCc1cnc2c(c1)nc(N)n2C1CNC(=O)C1
InChIInChI=1S/C11H13N5O/c1-6-2-8-10(14-4-6)16(11(12)15-8)7-3-9(17)13-5-7/h2,4,7H,3,5H2,1H3,(H2,12,15)(H,13,17)
InChIKeyQSVINARBSSKXJT-UHFFFAOYSA-N
MW231.26 g/mol
LogP0.38
Rot. Bonds1

About 4-(2-amino-6-methylimidazo[4,5-b]pyridin-3-yl)pyrrolidin-2-one

4-(2-amino-6-methylimidazo[4,5-b]pyridin-3-yl)pyrrolidin-2-one (PubChem CID 106186692) has the molecular formula C11H13N5O and a molecular weight of 231.26 g/mol. Its IUPAC name is 4-(2-amino-6-methylimidazo[4,5-b]pyridin-3-yl)pyrrolidin-2-one.

Molecular Properties

Compound Name4-(2-amino-6-methylimidazo[4,5-b]pyridin-3-yl)pyrrolidin-2-one
PubChem CID106186692
Molecular FormulaC11H13N5O
Molecular Weight231.26 g/mol
Exact Mass231.11
IUPAC Name4-(2-amino-6-methylimidazo[4,5-b]pyridin-3-yl)pyrrolidin-2-one
SMILESCc1cnc2c(c1)nc(N)n2C1CNC(=O)C1
InChIInChI=1S/C11H13N5O/c1-6-2-8-10(14-4-6)16(11(12)15-8)7-3-9(17)13-5-7/h2,4,7H,3,5H2,1H3,(H2,12,15)(H,13,17)
InChIKeyQSVINARBSSKXJT-UHFFFAOYSA-N
XLogP0.38
TPSA85.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.26
LogP ≤ 50.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(2-amino-6-methylimidazo[4,5-b]pyridin-3-yl)pyrrolidin-2-one?
The IUPAC name of 4-(2-amino-6-methylimidazo[4,5-b]pyridin-3-yl)pyrrolidin-2-one (CID 106186692) is 4-(2-amino-6-methylimidazo[4,5-b]pyridin-3-yl)pyrrolidin-2-one.
What is the SMILES notation for 4-(2-amino-6-methylimidazo[4,5-b]pyridin-3-yl)pyrrolidin-2-one?
The canonical SMILES for 4-(2-amino-6-methylimidazo[4,5-b]pyridin-3-yl)pyrrolidin-2-one is Cc1cnc2c(c1)nc(N)n2C1CNC(=O)C1.
What is the InChIKey of 4-(2-amino-6-methylimidazo[4,5-b]pyridin-3-yl)pyrrolidin-2-one?
The InChIKey is QSVINARBSSKXJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N5O/c1-6-2-8-10(14-4-6)16(11(12)15-8)7-3-9(17)13-5-7/h2,4,7H,3,5H2,1H3,(H2,12,15)(H,13,17).
What are the key properties of 4-(2-amino-6-methylimidazo[4,5-b]pyridin-3-yl)pyrrolidin-2-one?
4-(2-amino-6-methylimidazo[4,5-b]pyridin-3-yl)pyrrolidin-2-one has a molecular weight of 231.26 g/mol, XLogP of 0.38, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-amino-6-methylimidazo[4,5-b]pyridin-3-yl)pyrrolidin-2-one is sourced from PubChem (CID 106186692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).