2-(2-fluoro-5-methylphenyl)-1H-imidazo[4,5-b]pyridin-5-amine

C13H11FN4 — CID 79820730

IUPAC2-(2-fluoro-5-methylphenyl)-1H-imidazo[4,5-b]pyridin-5-amine
SMILESCc1ccc(F)c(-c2nc3nc(N)ccc3[nH]2)c1
InChIInChI=1S/C13H11FN4/c1-7-2-3-9(14)8(6-7)12-16-10-4-5-11(15)17-13(10)18-12/h2-6H,1H3,(H3,15,16,17,18)
InChIKeySCISTXDRNRSRHL-UHFFFAOYSA-N
MW242.26 g/mol
LogP2.65
Rot. Bonds1

About 2-(2-fluoro-5-methylphenyl)-1H-imidazo[4,5-b]pyridin-5-amine

2-(2-fluoro-5-methylphenyl)-1H-imidazo[4,5-b]pyridin-5-amine (PubChem CID 79820730) has the molecular formula C13H11FN4 and a molecular weight of 242.26 g/mol. Its IUPAC name is 2-(2-fluoro-5-methylphenyl)-1H-imidazo[4,5-b]pyridin-5-amine.

Molecular Properties

Compound Name2-(2-fluoro-5-methylphenyl)-1H-imidazo[4,5-b]pyridin-5-amine
PubChem CID79820730
Molecular FormulaC13H11FN4
Molecular Weight242.26 g/mol
Exact Mass242.10
IUPAC Name2-(2-fluoro-5-methylphenyl)-1H-imidazo[4,5-b]pyridin-5-amine
SMILESCc1ccc(F)c(-c2nc3nc(N)ccc3[nH]2)c1
InChIInChI=1S/C13H11FN4/c1-7-2-3-9(14)8(6-7)12-16-10-4-5-11(15)17-13(10)18-12/h2-6H,1H3,(H3,15,16,17,18)
InChIKeySCISTXDRNRSRHL-UHFFFAOYSA-N
XLogP2.65
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.26
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-fluoro-5-methylphenyl)-1H-imidazo[4,5-b]pyridin-5-amine?
The IUPAC name of 2-(2-fluoro-5-methylphenyl)-1H-imidazo[4,5-b]pyridin-5-amine (CID 79820730) is 2-(2-fluoro-5-methylphenyl)-1H-imidazo[4,5-b]pyridin-5-amine.
What is the SMILES notation for 2-(2-fluoro-5-methylphenyl)-1H-imidazo[4,5-b]pyridin-5-amine?
The canonical SMILES for 2-(2-fluoro-5-methylphenyl)-1H-imidazo[4,5-b]pyridin-5-amine is Cc1ccc(F)c(-c2nc3nc(N)ccc3[nH]2)c1.
What is the InChIKey of 2-(2-fluoro-5-methylphenyl)-1H-imidazo[4,5-b]pyridin-5-amine?
The InChIKey is SCISTXDRNRSRHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11FN4/c1-7-2-3-9(14)8(6-7)12-16-10-4-5-11(15)17-13(10)18-12/h2-6H,1H3,(H3,15,16,17,18).
What are the key properties of 2-(2-fluoro-5-methylphenyl)-1H-imidazo[4,5-b]pyridin-5-amine?
2-(2-fluoro-5-methylphenyl)-1H-imidazo[4,5-b]pyridin-5-amine has a molecular weight of 242.26 g/mol, XLogP of 2.65, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluoro-5-methylphenyl)-1H-imidazo[4,5-b]pyridin-5-amine is sourced from PubChem (CID 79820730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).