2-(2-aminoimidazo[4,5-b]pyridin-3-yl)phenol

C12H10N4O — CID 164612379

IUPAC2-(2-aminoimidazo[4,5-b]pyridin-3-yl)phenol
SMILESNc1nc2cccnc2n1-c1ccccc1O
InChIInChI=1S/C12H10N4O/c13-12-15-8-4-3-7-14-11(8)16(12)9-5-1-2-6-10(9)17/h1-7,17H,(H2,13,15)
InChIKeyAGAULUJNRRJPNU-UHFFFAOYSA-N
MW226.24 g/mol
LogP1.71
Rot. Bonds1

About 2-(2-aminoimidazo[4,5-b]pyridin-3-yl)phenol

2-(2-aminoimidazo[4,5-b]pyridin-3-yl)phenol (PubChem CID 164612379) has the molecular formula C12H10N4O and a molecular weight of 226.24 g/mol. Its IUPAC name is 2-(2-aminoimidazo[4,5-b]pyridin-3-yl)phenol.

Molecular Properties

Compound Name2-(2-aminoimidazo[4,5-b]pyridin-3-yl)phenol
PubChem CID164612379
Molecular FormulaC12H10N4O
Molecular Weight226.24 g/mol
Exact Mass226.09
IUPAC Name2-(2-aminoimidazo[4,5-b]pyridin-3-yl)phenol
SMILESNc1nc2cccnc2n1-c1ccccc1O
InChIInChI=1S/C12H10N4O/c13-12-15-8-4-3-7-14-11(8)16(12)9-5-1-2-6-10(9)17/h1-7,17H,(H2,13,15)
InChIKeyAGAULUJNRRJPNU-UHFFFAOYSA-N
XLogP1.71
TPSA76.96 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.24
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(2-aminoimidazo[4,5-b]pyridin-3-yl)phenol?
The IUPAC name of 2-(2-aminoimidazo[4,5-b]pyridin-3-yl)phenol (CID 164612379) is 2-(2-aminoimidazo[4,5-b]pyridin-3-yl)phenol.
What is the SMILES notation for 2-(2-aminoimidazo[4,5-b]pyridin-3-yl)phenol?
The canonical SMILES for 2-(2-aminoimidazo[4,5-b]pyridin-3-yl)phenol is Nc1nc2cccnc2n1-c1ccccc1O.
What is the InChIKey of 2-(2-aminoimidazo[4,5-b]pyridin-3-yl)phenol?
The InChIKey is AGAULUJNRRJPNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N4O/c13-12-15-8-4-3-7-14-11(8)16(12)9-5-1-2-6-10(9)17/h1-7,17H,(H2,13,15).
What are the key properties of 2-(2-aminoimidazo[4,5-b]pyridin-3-yl)phenol?
2-(2-aminoimidazo[4,5-b]pyridin-3-yl)phenol has a molecular weight of 226.24 g/mol, XLogP of 1.71, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminoimidazo[4,5-b]pyridin-3-yl)phenol is sourced from PubChem (CID 164612379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).