N-[4-(1H-imidazo[4,5-b]pyridin-2-yl)phenyl]-2-(4-phenylphenoxy)acetamide

C26H20N4O2 — CID 162677278

IUPACN-[4-(1H-imidazo[4,5-b]pyridin-2-yl)phenyl]-2-(4-phenylphenoxy)acetamide
SMILESO=C(COc1ccc(-c2ccccc2)cc1)Nc1ccc(-c2nc3ncccc3[nH]2)cc1
InChIInChI=1S/C26H20N4O2/c31-24(17-32-22-14-10-19(11-15-22)18-5-2-1-3-6-18)28-21-12-8-20(9-13-21)25-29-23-7-4-16-27-26(23)30-25/h1-16H,17H2,(H,28,31)(H,27,29,30)
InChIKeyVRHBCZCODVPSEK-UHFFFAOYSA-N
MW420.47 g/mol
LogP5.31
Rot. Bonds6

About N-[4-(1H-imidazo[4,5-b]pyridin-2-yl)phenyl]-2-(4-phenylphenoxy)acetamide

N-[4-(1H-imidazo[4,5-b]pyridin-2-yl)phenyl]-2-(4-phenylphenoxy)acetamide (PubChem CID 162677278) has the molecular formula C26H20N4O2 and a molecular weight of 420.47 g/mol. Its IUPAC name is N-[4-(1H-imidazo[4,5-b]pyridin-2-yl)phenyl]-2-(4-phenylphenoxy)acetamide.

Molecular Properties

Compound NameN-[4-(1H-imidazo[4,5-b]pyridin-2-yl)phenyl]-2-(4-phenylphenoxy)acetamide
PubChem CID162677278
Molecular FormulaC26H20N4O2
Molecular Weight420.47 g/mol
Exact Mass420.16
IUPAC NameN-[4-(1H-imidazo[4,5-b]pyridin-2-yl)phenyl]-2-(4-phenylphenoxy)acetamide
SMILESO=C(COc1ccc(-c2ccccc2)cc1)Nc1ccc(-c2nc3ncccc3[nH]2)cc1
InChIInChI=1S/C26H20N4O2/c31-24(17-32-22-14-10-19(11-15-22)18-5-2-1-3-6-18)28-21-12-8-20(9-13-21)25-29-23-7-4-16-27-26(23)30-25/h1-16H,17H2,(H,28,31)(H,27,29,30)
InChIKeyVRHBCZCODVPSEK-UHFFFAOYSA-N
XLogP5.31
TPSA79.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500420.47
LogP ≤ 55.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[4-(1H-imidazo[4,5-b]pyridin-2-yl)phenyl]-2-(4-phenylphenoxy)acetamide?
The IUPAC name of N-[4-(1H-imidazo[4,5-b]pyridin-2-yl)phenyl]-2-(4-phenylphenoxy)acetamide (CID 162677278) is N-[4-(1H-imidazo[4,5-b]pyridin-2-yl)phenyl]-2-(4-phenylphenoxy)acetamide.
What is the SMILES notation for N-[4-(1H-imidazo[4,5-b]pyridin-2-yl)phenyl]-2-(4-phenylphenoxy)acetamide?
The canonical SMILES for N-[4-(1H-imidazo[4,5-b]pyridin-2-yl)phenyl]-2-(4-phenylphenoxy)acetamide is O=C(COc1ccc(-c2ccccc2)cc1)Nc1ccc(-c2nc3ncccc3[nH]2)cc1.
What is the InChIKey of N-[4-(1H-imidazo[4,5-b]pyridin-2-yl)phenyl]-2-(4-phenylphenoxy)acetamide?
The InChIKey is VRHBCZCODVPSEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H20N4O2/c31-24(17-32-22-14-10-19(11-15-22)18-5-2-1-3-6-18)28-21-12-8-20(9-13-21)25-29-23-7-4-16-27-26(23)30-25/h1-16H,17H2,(H,28,31)(H,27,29,30).
What are the key properties of N-[4-(1H-imidazo[4,5-b]pyridin-2-yl)phenyl]-2-(4-phenylphenoxy)acetamide?
N-[4-(1H-imidazo[4,5-b]pyridin-2-yl)phenyl]-2-(4-phenylphenoxy)acetamide has a molecular weight of 420.47 g/mol, XLogP of 5.31, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(1H-imidazo[4,5-b]pyridin-2-yl)phenyl]-2-(4-phenylphenoxy)acetamide is sourced from PubChem (CID 162677278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).