5-methoxy-N-phenyl-1H-imidazo[4,5-b]pyridin-2-amine

C13H12N4O — CID 141189251

IUPAC5-methoxy-N-phenyl-1H-imidazo[4,5-b]pyridin-2-amine
SMILESCOc1ccc2[nH]c(Nc3ccccc3)nc2n1
InChIInChI=1S/C13H12N4O/c1-18-11-8-7-10-12(16-11)17-13(15-10)14-9-5-3-2-4-6-9/h2-8H,1H3,(H2,14,15,16,17)
InChIKeyREWXCBHNBXRCMZ-UHFFFAOYSA-N
MW240.27 g/mol
LogP2.71
Rot. Bonds3

About 5-methoxy-N-phenyl-1H-imidazo[4,5-b]pyridin-2-amine

5-methoxy-N-phenyl-1H-imidazo[4,5-b]pyridin-2-amine (PubChem CID 141189251) has the molecular formula C13H12N4O and a molecular weight of 240.27 g/mol. Its IUPAC name is 5-methoxy-N-phenyl-1H-imidazo[4,5-b]pyridin-2-amine.

Molecular Properties

Compound Name5-methoxy-N-phenyl-1H-imidazo[4,5-b]pyridin-2-amine
PubChem CID141189251
Molecular FormulaC13H12N4O
Molecular Weight240.27 g/mol
Exact Mass240.10
IUPAC Name5-methoxy-N-phenyl-1H-imidazo[4,5-b]pyridin-2-amine
SMILESCOc1ccc2[nH]c(Nc3ccccc3)nc2n1
InChIInChI=1S/C13H12N4O/c1-18-11-8-7-10-12(16-11)17-13(15-10)14-9-5-3-2-4-6-9/h2-8H,1H3,(H2,14,15,16,17)
InChIKeyREWXCBHNBXRCMZ-UHFFFAOYSA-N
XLogP2.71
TPSA62.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.27
LogP ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-methoxy-N-phenyl-1H-imidazo[4,5-b]pyridin-2-amine?
The IUPAC name of 5-methoxy-N-phenyl-1H-imidazo[4,5-b]pyridin-2-amine (CID 141189251) is 5-methoxy-N-phenyl-1H-imidazo[4,5-b]pyridin-2-amine.
What is the SMILES notation for 5-methoxy-N-phenyl-1H-imidazo[4,5-b]pyridin-2-amine?
The canonical SMILES for 5-methoxy-N-phenyl-1H-imidazo[4,5-b]pyridin-2-amine is COc1ccc2[nH]c(Nc3ccccc3)nc2n1.
What is the InChIKey of 5-methoxy-N-phenyl-1H-imidazo[4,5-b]pyridin-2-amine?
The InChIKey is REWXCBHNBXRCMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N4O/c1-18-11-8-7-10-12(16-11)17-13(15-10)14-9-5-3-2-4-6-9/h2-8H,1H3,(H2,14,15,16,17).
What are the key properties of 5-methoxy-N-phenyl-1H-imidazo[4,5-b]pyridin-2-amine?
5-methoxy-N-phenyl-1H-imidazo[4,5-b]pyridin-2-amine has a molecular weight of 240.27 g/mol, XLogP of 2.71, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-N-phenyl-1H-imidazo[4,5-b]pyridin-2-amine is sourced from PubChem (CID 141189251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).