2-[4-(2-phenylimidazo[4,5-b]pyridin-3-yl)phenyl]-N-propan-2-ylacetamide

C23H22N4O — CID 20916212

IUPAC2-[4-(2-phenylimidazo[4,5-b]pyridin-3-yl)phenyl]-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)Cc1ccc(-n2c(-c3ccccc3)nc3cccnc32)cc1
InChIInChI=1S/C23H22N4O/c1-16(2)25-21(28)15-17-10-12-19(13-11-17)27-22(18-7-4-3-5-8-18)26-20-9-6-14-24-23(20)27/h3-14,16H,15H2,1-2H3,(H,25,28)
InChIKeyJMUIRIWMLFVROW-UHFFFAOYSA-N
MW370.46 g/mol
LogP4.15
Rot. Bonds5

About 2-[4-(2-phenylimidazo[4,5-b]pyridin-3-yl)phenyl]-N-propan-2-ylacetamide

2-[4-(2-phenylimidazo[4,5-b]pyridin-3-yl)phenyl]-N-propan-2-ylacetamide (PubChem CID 20916212) has the molecular formula C23H22N4O and a molecular weight of 370.46 g/mol. Its IUPAC name is 2-[4-(2-phenylimidazo[4,5-b]pyridin-3-yl)phenyl]-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-[4-(2-phenylimidazo[4,5-b]pyridin-3-yl)phenyl]-N-propan-2-ylacetamide
PubChem CID20916212
Molecular FormulaC23H22N4O
Molecular Weight370.46 g/mol
Exact Mass370.18
IUPAC Name2-[4-(2-phenylimidazo[4,5-b]pyridin-3-yl)phenyl]-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)Cc1ccc(-n2c(-c3ccccc3)nc3cccnc32)cc1
InChIInChI=1S/C23H22N4O/c1-16(2)25-21(28)15-17-10-12-19(13-11-17)27-22(18-7-4-3-5-8-18)26-20-9-6-14-24-23(20)27/h3-14,16H,15H2,1-2H3,(H,25,28)
InChIKeyJMUIRIWMLFVROW-UHFFFAOYSA-N
XLogP4.15
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.46
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-phenylimidazo[4,5-b]pyridin-3-yl)phenyl]-N-propan-2-ylacetamide?
The IUPAC name of 2-[4-(2-phenylimidazo[4,5-b]pyridin-3-yl)phenyl]-N-propan-2-ylacetamide (CID 20916212) is 2-[4-(2-phenylimidazo[4,5-b]pyridin-3-yl)phenyl]-N-propan-2-ylacetamide.
What is the SMILES notation for 2-[4-(2-phenylimidazo[4,5-b]pyridin-3-yl)phenyl]-N-propan-2-ylacetamide?
The canonical SMILES for 2-[4-(2-phenylimidazo[4,5-b]pyridin-3-yl)phenyl]-N-propan-2-ylacetamide is CC(C)NC(=O)Cc1ccc(-n2c(-c3ccccc3)nc3cccnc32)cc1.
What is the InChIKey of 2-[4-(2-phenylimidazo[4,5-b]pyridin-3-yl)phenyl]-N-propan-2-ylacetamide?
The InChIKey is JMUIRIWMLFVROW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N4O/c1-16(2)25-21(28)15-17-10-12-19(13-11-17)27-22(18-7-4-3-5-8-18)26-20-9-6-14-24-23(20)27/h3-14,16H,15H2,1-2H3,(H,25,28).
What are the key properties of 2-[4-(2-phenylimidazo[4,5-b]pyridin-3-yl)phenyl]-N-propan-2-ylacetamide?
2-[4-(2-phenylimidazo[4,5-b]pyridin-3-yl)phenyl]-N-propan-2-ylacetamide has a molecular weight of 370.46 g/mol, XLogP of 4.15, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-phenylimidazo[4,5-b]pyridin-3-yl)phenyl]-N-propan-2-ylacetamide is sourced from PubChem (CID 20916212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).