4-(2-amino-1-methylimidazo[4,5-b]pyridin-6-yl)phenol

C13H12N4O — CID 15897928

IUPAC4-(2-amino-1-methylimidazo[4,5-b]pyridin-6-yl)phenol
SMILESCn1c(N)nc2ncc(-c3ccc(O)cc3)cc21
InChIInChI=1S/C13H12N4O/c1-17-11-6-9(7-15-12(11)16-13(17)14)8-2-4-10(18)5-3-8/h2-7,18H,1H3,(H2,14,15,16)
InChIKeyUGJXOCBVCWTJFP-UHFFFAOYSA-N
MW240.27 g/mol
LogP1.92
Rot. Bonds1

About 4-(2-amino-1-methylimidazo[4,5-b]pyridin-6-yl)phenol

4-(2-amino-1-methylimidazo[4,5-b]pyridin-6-yl)phenol (PubChem CID 15897928) has the molecular formula C13H12N4O and a molecular weight of 240.27 g/mol. Its IUPAC name is 4-(2-amino-1-methylimidazo[4,5-b]pyridin-6-yl)phenol.

Molecular Properties

Compound Name4-(2-amino-1-methylimidazo[4,5-b]pyridin-6-yl)phenol
PubChem CID15897928
Molecular FormulaC13H12N4O
Molecular Weight240.27 g/mol
Exact Mass240.10
IUPAC Name4-(2-amino-1-methylimidazo[4,5-b]pyridin-6-yl)phenol
SMILESCn1c(N)nc2ncc(-c3ccc(O)cc3)cc21
InChIInChI=1S/C13H12N4O/c1-17-11-6-9(7-15-12(11)16-13(17)14)8-2-4-10(18)5-3-8/h2-7,18H,1H3,(H2,14,15,16)
InChIKeyUGJXOCBVCWTJFP-UHFFFAOYSA-N
XLogP1.92
TPSA76.96 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.27
LogP ≤ 51.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(2-amino-1-methylimidazo[4,5-b]pyridin-6-yl)phenol?
The IUPAC name of 4-(2-amino-1-methylimidazo[4,5-b]pyridin-6-yl)phenol (CID 15897928) is 4-(2-amino-1-methylimidazo[4,5-b]pyridin-6-yl)phenol.
What is the SMILES notation for 4-(2-amino-1-methylimidazo[4,5-b]pyridin-6-yl)phenol?
The canonical SMILES for 4-(2-amino-1-methylimidazo[4,5-b]pyridin-6-yl)phenol is Cn1c(N)nc2ncc(-c3ccc(O)cc3)cc21.
What is the InChIKey of 4-(2-amino-1-methylimidazo[4,5-b]pyridin-6-yl)phenol?
The InChIKey is UGJXOCBVCWTJFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N4O/c1-17-11-6-9(7-15-12(11)16-13(17)14)8-2-4-10(18)5-3-8/h2-7,18H,1H3,(H2,14,15,16).
What are the key properties of 4-(2-amino-1-methylimidazo[4,5-b]pyridin-6-yl)phenol?
4-(2-amino-1-methylimidazo[4,5-b]pyridin-6-yl)phenol has a molecular weight of 240.27 g/mol, XLogP of 1.92, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-amino-1-methylimidazo[4,5-b]pyridin-6-yl)phenol is sourced from PubChem (CID 15897928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).