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

C24H25N5O2 — CID 71841244

IUPACN-[2-(1-benzyl-2-oxoimidazo[4,5-b]pyridin-3-yl)ethyl]-3-(dimethylamino)benzamide
SMILESCN(C)c1cccc(C(=O)NCCn2c(=O)n(Cc3ccccc3)c3cccnc32)c1
InChIInChI=1S/C24H25N5O2/c1-27(2)20-11-6-10-19(16-20)23(30)26-14-15-28-22-21(12-7-13-25-22)29(24(28)31)17-18-8-4-3-5-9-18/h3-13,16H,14-15,17H2,1-2H3,(H,26,30)
InChIKeyFASMXMRPPKYJPG-UHFFFAOYSA-N
MW415.50 g/mol
LogP2.74
Rot. Bonds7

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

N-[2-(1-benzyl-2-oxoimidazo[4,5-b]pyridin-3-yl)ethyl]-3-(dimethylamino)benzamide (PubChem CID 71841244) has the molecular formula C24H25N5O2 and a molecular weight of 415.50 g/mol. Its IUPAC name is N-[2-(1-benzyl-2-oxoimidazo[4,5-b]pyridin-3-yl)ethyl]-3-(dimethylamino)benzamide.

Molecular Properties

Compound NameN-[2-(1-benzyl-2-oxoimidazo[4,5-b]pyridin-3-yl)ethyl]-3-(dimethylamino)benzamide
PubChem CID71841244
Molecular FormulaC24H25N5O2
Molecular Weight415.50 g/mol
Exact Mass415.20
IUPAC NameN-[2-(1-benzyl-2-oxoimidazo[4,5-b]pyridin-3-yl)ethyl]-3-(dimethylamino)benzamide
SMILESCN(C)c1cccc(C(=O)NCCn2c(=O)n(Cc3ccccc3)c3cccnc32)c1
InChIInChI=1S/C24H25N5O2/c1-27(2)20-11-6-10-19(16-20)23(30)26-14-15-28-22-21(12-7-13-25-22)29(24(28)31)17-18-8-4-3-5-9-18/h3-13,16H,14-15,17H2,1-2H3,(H,26,30)
InChIKeyFASMXMRPPKYJPG-UHFFFAOYSA-N
XLogP2.74
TPSA72.16 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500415.50
LogP ≤ 52.74
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]pyridine-2-carboxamide
CID 71841230
N-[2-(1-benzyl-2-oxoimidazo[4,5-b]pyridin-3-yl)ethyl]-4-cyanobenzamide
CID 71841253
3-cyano-N-[2-[1-[(3-methylphenyl)methyl]-2-oxoimidazo[4,5-b]pyridin-3-yl]ethyl]benzamide
CID 71841078
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]-2,4-difluorobenzamide
CID 71841245
4-cyano-N-[2-[1-[(3-methylphenyl)methyl]-2-oxoimidazo[4,5-b]pyridin-3-yl]ethyl]benzamide
CID 71841066
2-(3-chlorophenyl)-N-[2-[1-[(4-methylphenyl)methyl]-2-oxoimidazo[4,5-b]pyridin-3-yl]ethyl]acetamide
CID 71841196
N-[2-(1-benzyl-2-oxoimidazo[4,5-b]pyridin-3-yl)ethyl]cyclohexanecarboxamide
CID 53159393
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]-2-phenylpropanamide
CID 71841205
N-[2-[1-[(4-methylphenyl)methyl]-2-oxoimidazo[4,5-b]pyridin-3-yl]ethyl]pyrazine-2-carboxamide
CID 71841171
3-(dimethylamino)-N-(3-phenylpropyl)benzamide
CID 25335787

Frequently Asked Questions

What is the IUPAC name of N-[2-(1-benzyl-2-oxoimidazo[4,5-b]pyridin-3-yl)ethyl]-3-(dimethylamino)benzamide?
The IUPAC name of N-[2-(1-benzyl-2-oxoimidazo[4,5-b]pyridin-3-yl)ethyl]-3-(dimethylamino)benzamide (CID 71841244) is N-[2-(1-benzyl-2-oxoimidazo[4,5-b]pyridin-3-yl)ethyl]-3-(dimethylamino)benzamide.
What is the SMILES notation for N-[2-(1-benzyl-2-oxoimidazo[4,5-b]pyridin-3-yl)ethyl]-3-(dimethylamino)benzamide?
The canonical SMILES for N-[2-(1-benzyl-2-oxoimidazo[4,5-b]pyridin-3-yl)ethyl]-3-(dimethylamino)benzamide is CN(C)c1cccc(C(=O)NCCn2c(=O)n(Cc3ccccc3)c3cccnc32)c1.
What is the InChIKey of N-[2-(1-benzyl-2-oxoimidazo[4,5-b]pyridin-3-yl)ethyl]-3-(dimethylamino)benzamide?
The InChIKey is FASMXMRPPKYJPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N5O2/c1-27(2)20-11-6-10-19(16-20)23(30)26-14-15-28-22-21(12-7-13-25-22)29(24(28)31)17-18-8-4-3-5-9-18/h3-13,16H,14-15,17H2,1-2H3,(H,26,30).
What are the key properties of N-[2-(1-benzyl-2-oxoimidazo[4,5-b]pyridin-3-yl)ethyl]-3-(dimethylamino)benzamide?
N-[2-(1-benzyl-2-oxoimidazo[4,5-b]pyridin-3-yl)ethyl]-3-(dimethylamino)benzamide has a molecular weight of 415.50 g/mol, XLogP of 2.74, 7 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]-3-(dimethylamino)benzamide is sourced from PubChem (CID 71841244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).