4-(2-ethylimidazo[4,5-b]pyridin-3-yl)-N-(pyridin-2-ylmethyl)benzamide

C21H19N5O — CID 20916068

IUPAC4-(2-ethylimidazo[4,5-b]pyridin-3-yl)-N-(pyridin-2-ylmethyl)benzamide
SMILESCCc1nc2cccnc2n1-c1ccc(C(=O)NCc2ccccn2)cc1
InChIInChI=1S/C21H19N5O/c1-2-19-25-18-7-5-13-23-20(18)26(19)17-10-8-15(9-11-17)21(27)24-14-16-6-3-4-12-22-16/h3-13H,2,14H2,1H3,(H,24,27)
InChIKeyALPCMQXHWDBSHV-UHFFFAOYSA-N
MW357.42 g/mol
LogP3.31
Rot. Bonds5

About 4-(2-ethylimidazo[4,5-b]pyridin-3-yl)-N-(pyridin-2-ylmethyl)benzamide

4-(2-ethylimidazo[4,5-b]pyridin-3-yl)-N-(pyridin-2-ylmethyl)benzamide (PubChem CID 20916068) has the molecular formula C21H19N5O and a molecular weight of 357.42 g/mol. Its IUPAC name is 4-(2-ethylimidazo[4,5-b]pyridin-3-yl)-N-(pyridin-2-ylmethyl)benzamide.

Molecular Properties

Compound Name4-(2-ethylimidazo[4,5-b]pyridin-3-yl)-N-(pyridin-2-ylmethyl)benzamide
PubChem CID20916068
Molecular FormulaC21H19N5O
Molecular Weight357.42 g/mol
Exact Mass357.16
IUPAC Name4-(2-ethylimidazo[4,5-b]pyridin-3-yl)-N-(pyridin-2-ylmethyl)benzamide
SMILESCCc1nc2cccnc2n1-c1ccc(C(=O)NCc2ccccn2)cc1
InChIInChI=1S/C21H19N5O/c1-2-19-25-18-7-5-13-23-20(18)26(19)17-10-8-15(9-11-17)21(27)24-14-16-6-3-4-12-22-16/h3-13H,2,14H2,1H3,(H,24,27)
InChIKeyALPCMQXHWDBSHV-UHFFFAOYSA-N
XLogP3.31
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.42
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(3-oxo-4-propylpyrido[2,3-b]pyrazin-2-yl)-N-(pyridin-2-ylmethyl)benzamide
CID 46393908
1-(4-bromophenyl)-2-methyl-N-(pyridin-2-ylmethyl)benzimidazole-5-carboxamide
CID 6617180
4-pyrazol-1-yl-N-(pyridin-2-ylmethyl)benzamide
CID 40673388
methyl 4-(pyridin-2-ylmethylcarbamoyl)benzoate
CID 9414602
4-(2-phenylimidazo[4,5-b]pyridin-3-yl)-N-(pyridin-3-ylmethyl)benzamide
CID 20916096
4-(2-methyl-4-oxo-6-prop-2-enoxyquinazolin-3-yl)-N-(pyridin-2-ylmethyl)benzamide
CID 29135509
4-(methylaminomethyl)-N-(pyridin-2-ylmethyl)benzamide
CID 90338069
N-[2-(dimethylamino)ethyl]-4-(2-phenylimidazo[4,5-b]pyridin-3-yl)benzamide
CID 20916098
4-(acetamidomethyl)-N-(pyridin-2-ylmethyl)benzamide
CID 18107584
2,3-dipropyl-N-(pyridin-2-ylmethyl)benzimidazole-5-carboxamide
CID 152760188
2-methyl-6-oxo-N-(pyridin-2-ylmethyl)-1H-pyridine-4-carboxamide
CID 110698624
2-[4-(2-ethylimidazo[4,5-b]pyridin-3-yl)phenyl]-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
CID 20916194

Frequently Asked Questions

What is the IUPAC name of 4-(2-ethylimidazo[4,5-b]pyridin-3-yl)-N-(pyridin-2-ylmethyl)benzamide?
The IUPAC name of 4-(2-ethylimidazo[4,5-b]pyridin-3-yl)-N-(pyridin-2-ylmethyl)benzamide (CID 20916068) is 4-(2-ethylimidazo[4,5-b]pyridin-3-yl)-N-(pyridin-2-ylmethyl)benzamide.
What is the SMILES notation for 4-(2-ethylimidazo[4,5-b]pyridin-3-yl)-N-(pyridin-2-ylmethyl)benzamide?
The canonical SMILES for 4-(2-ethylimidazo[4,5-b]pyridin-3-yl)-N-(pyridin-2-ylmethyl)benzamide is CCc1nc2cccnc2n1-c1ccc(C(=O)NCc2ccccn2)cc1.
What is the InChIKey of 4-(2-ethylimidazo[4,5-b]pyridin-3-yl)-N-(pyridin-2-ylmethyl)benzamide?
The InChIKey is ALPCMQXHWDBSHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N5O/c1-2-19-25-18-7-5-13-23-20(18)26(19)17-10-8-15(9-11-17)21(27)24-14-16-6-3-4-12-22-16/h3-13H,2,14H2,1H3,(H,24,27).
What are the key properties of 4-(2-ethylimidazo[4,5-b]pyridin-3-yl)-N-(pyridin-2-ylmethyl)benzamide?
4-(2-ethylimidazo[4,5-b]pyridin-3-yl)-N-(pyridin-2-ylmethyl)benzamide has a molecular weight of 357.42 g/mol, XLogP of 3.31, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-ethylimidazo[4,5-b]pyridin-3-yl)-N-(pyridin-2-ylmethyl)benzamide is sourced from PubChem (CID 20916068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).