N-[2-(1-benzyl-2-oxoimidazo[4,5-b]pyridin-3-yl)ethyl]pyridine-2-carboxamide

C21H19N5O2 — CID 71841230

IUPACN-[2-(1-benzyl-2-oxoimidazo[4,5-b]pyridin-3-yl)ethyl]pyridine-2-carboxamide
SMILESO=C(NCCn1c(=O)n(Cc2ccccc2)c2cccnc21)c1ccccn1
InChIInChI=1S/C21H19N5O2/c27-20(17-9-4-5-11-22-17)24-13-14-25-19-18(10-6-12-23-19)26(21(25)28)15-16-7-2-1-3-8-16/h1-12H,13-15H2,(H,24,27)
InChIKeyGEFFZTZWZCUWSB-UHFFFAOYSA-N
MW373.42 g/mol
LogP2.07
Rot. Bonds6

About N-[2-(1-benzyl-2-oxoimidazo[4,5-b]pyridin-3-yl)ethyl]pyridine-2-carboxamide

N-[2-(1-benzyl-2-oxoimidazo[4,5-b]pyridin-3-yl)ethyl]pyridine-2-carboxamide (PubChem CID 71841230) has the molecular formula C21H19N5O2 and a molecular weight of 373.42 g/mol. Its IUPAC name is N-[2-(1-benzyl-2-oxoimidazo[4,5-b]pyridin-3-yl)ethyl]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[2-(1-benzyl-2-oxoimidazo[4,5-b]pyridin-3-yl)ethyl]pyridine-2-carboxamide
PubChem CID71841230
Molecular FormulaC21H19N5O2
Molecular Weight373.42 g/mol
Exact Mass373.15
IUPAC NameN-[2-(1-benzyl-2-oxoimidazo[4,5-b]pyridin-3-yl)ethyl]pyridine-2-carboxamide
SMILESO=C(NCCn1c(=O)n(Cc2ccccc2)c2cccnc21)c1ccccn1
InChIInChI=1S/C21H19N5O2/c27-20(17-9-4-5-11-22-17)24-13-14-25-19-18(10-6-12-23-19)26(21(25)28)15-16-7-2-1-3-8-16/h1-12H,13-15H2,(H,24,27)
InChIKeyGEFFZTZWZCUWSB-UHFFFAOYSA-N
XLogP2.07
TPSA81.81 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.42
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[2-(1-benzyl-2-oxoimidazo[4,5-b]pyridin-3-yl)ethyl]-4-cyanobenzamide
CID 71841253
N-[2-(1-benzyl-2-oxoimidazo[4,5-b]pyridin-3-yl)ethyl]-2,4-difluorobenzamide
CID 71841245
N-[2-[1-[(4-methylphenyl)methyl]-2-oxoimidazo[4,5-b]pyridin-3-yl]ethyl]pyrazine-2-carboxamide
CID 71841171
4-fluoro-N-[2-[1-[(4-fluorophenyl)methyl]-2-oxoimidazo[4,5-b]pyridin-3-yl]ethyl]benzamide
CID 71841124
N-[2-(1-benzyl-2-oxoimidazo[4,5-b]pyridin-3-yl)ethyl]-3-(dimethylamino)benzamide
CID 71841244
N-[2-(1-benzyl-2-oxoimidazo[4,5-b]pyridin-3-yl)ethyl]cyclohexanecarboxamide
CID 53159393
N-[2-[1-[(4-methylphenyl)methyl]-2-oxoimidazo[4,5-b]pyridin-3-yl]ethyl]-2-phenylpropanamide
CID 71841205
2-(3-chlorophenyl)-N-[2-[1-[(4-methylphenyl)methyl]-2-oxoimidazo[4,5-b]pyridin-3-yl]ethyl]acetamide
CID 71841196
4-cyano-N-[2-[1-[(4-fluorophenyl)methyl]-2-oxoimidazo[4,5-b]pyridin-3-yl]ethyl]benzamide
CID 71841123
N-[2-[1-[(4-methylphenyl)methyl]-2-oxoimidazo[4,5-b]pyridin-3-yl]ethyl]-1-phenylcyclopropane-1-carboxamide
CID 71841173
N-[2-[1-[(4-fluorophenyl)methyl]-2-oxoimidazo[4,5-b]pyridin-3-yl]ethyl]cyclopropanecarboxamide
CID 53159427
4-cyano-N-[2-[1-[(3-methylphenyl)methyl]-2-oxoimidazo[4,5-b]pyridin-3-yl]ethyl]benzamide
CID 71841066

Frequently Asked Questions

What is the IUPAC name of N-[2-(1-benzyl-2-oxoimidazo[4,5-b]pyridin-3-yl)ethyl]pyridine-2-carboxamide?
The IUPAC name of N-[2-(1-benzyl-2-oxoimidazo[4,5-b]pyridin-3-yl)ethyl]pyridine-2-carboxamide (CID 71841230) is N-[2-(1-benzyl-2-oxoimidazo[4,5-b]pyridin-3-yl)ethyl]pyridine-2-carboxamide.
What is the SMILES notation for N-[2-(1-benzyl-2-oxoimidazo[4,5-b]pyridin-3-yl)ethyl]pyridine-2-carboxamide?
The canonical SMILES for N-[2-(1-benzyl-2-oxoimidazo[4,5-b]pyridin-3-yl)ethyl]pyridine-2-carboxamide is O=C(NCCn1c(=O)n(Cc2ccccc2)c2cccnc21)c1ccccn1.
What is the InChIKey of N-[2-(1-benzyl-2-oxoimidazo[4,5-b]pyridin-3-yl)ethyl]pyridine-2-carboxamide?
The InChIKey is GEFFZTZWZCUWSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N5O2/c27-20(17-9-4-5-11-22-17)24-13-14-25-19-18(10-6-12-23-19)26(21(25)28)15-16-7-2-1-3-8-16/h1-12H,13-15H2,(H,24,27).
What are the key properties of N-[2-(1-benzyl-2-oxoimidazo[4,5-b]pyridin-3-yl)ethyl]pyridine-2-carboxamide?
N-[2-(1-benzyl-2-oxoimidazo[4,5-b]pyridin-3-yl)ethyl]pyridine-2-carboxamide has a molecular weight of 373.42 g/mol, XLogP of 2.07, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1-benzyl-2-oxoimidazo[4,5-b]pyridin-3-yl)ethyl]pyridine-2-carboxamide is sourced from PubChem (CID 71841230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).