3-[3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]-N-phenylpropanamide

C23H22N4O2 — CID 6619626

IUPAC3-[3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]-N-phenylpropanamide
SMILESCOc1ccc(Cn2c(CCC(=O)Nc3ccccc3)nc3cccnc32)cc1
InChIInChI=1S/C23H22N4O2/c1-29-19-11-9-17(10-12-19)16-27-21(26-20-8-5-15-24-23(20)27)13-14-22(28)25-18-6-3-2-4-7-18/h2-12,15H,13-14,16H2,1H3,(H,25,28)
InChIKeyRSWKWPLXVTXUAJ-UHFFFAOYSA-N
MW386.46 g/mol
LogP4.06
Rot. Bonds7

About 3-[3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]-N-phenylpropanamide

3-[3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]-N-phenylpropanamide (PubChem CID 6619626) has the molecular formula C23H22N4O2 and a molecular weight of 386.46 g/mol. Its IUPAC name is 3-[3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]-N-phenylpropanamide.

Molecular Properties

Compound Name3-[3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]-N-phenylpropanamide
PubChem CID6619626
Molecular FormulaC23H22N4O2
Molecular Weight386.46 g/mol
Exact Mass386.17
IUPAC Name3-[3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]-N-phenylpropanamide
SMILESCOc1ccc(Cn2c(CCC(=O)Nc3ccccc3)nc3cccnc32)cc1
InChIInChI=1S/C23H22N4O2/c1-29-19-11-9-17(10-12-19)16-27-21(26-20-8-5-15-24-23(20)27)13-14-22(28)25-18-6-3-2-4-7-18/h2-12,15H,13-14,16H2,1H3,(H,25,28)
InChIKeyRSWKWPLXVTXUAJ-UHFFFAOYSA-N
XLogP4.06
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.46
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-[3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]-N-phenylpropanamide?
The IUPAC name of 3-[3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]-N-phenylpropanamide (CID 6619626) is 3-[3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]-N-phenylpropanamide.
What is the SMILES notation for 3-[3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]-N-phenylpropanamide?
The canonical SMILES for 3-[3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]-N-phenylpropanamide is COc1ccc(Cn2c(CCC(=O)Nc3ccccc3)nc3cccnc32)cc1.
What is the InChIKey of 3-[3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]-N-phenylpropanamide?
The InChIKey is RSWKWPLXVTXUAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N4O2/c1-29-19-11-9-17(10-12-19)16-27-21(26-20-8-5-15-24-23(20)27)13-14-22(28)25-18-6-3-2-4-7-18/h2-12,15H,13-14,16H2,1H3,(H,25,28).
What are the key properties of 3-[3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]-N-phenylpropanamide?
3-[3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]-N-phenylpropanamide has a molecular weight of 386.46 g/mol, XLogP of 4.06, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-[(4-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]-N-phenylpropanamide is sourced from PubChem (CID 6619626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).