5-N,6-N-dibenzyl-7-(4-methoxyphenyl)imidazo[1,2-a]pyridine-5,6-dicarboxamide

C30H26N4O3 — CID 121392249

IUPAC5-N,6-N-dibenzyl-7-(4-methoxyphenyl)imidazo[1,2-a]pyridine-5,6-dicarboxamide
SMILESCOc1ccc(-c2cc3nccn3c(C(=O)NCc3ccccc3)c2C(=O)NCc2ccccc2)cc1
InChIInChI=1S/C30H26N4O3/c1-37-24-14-12-23(13-15-24)25-18-26-31-16-17-34(26)28(30(36)33-20-22-10-6-3-7-11-22)27(25)29(35)32-19-21-8-4-2-5-9-21/h2-18H,19-20H2,1H3,(H,32,35)(H,33,36)
InChIKeyUBYSPIGZMUUQKG-UHFFFAOYSA-N
MW490.56 g/mol
LogP4.87
Rot. Bonds8

About 5-N,6-N-dibenzyl-7-(4-methoxyphenyl)imidazo[1,2-a]pyridine-5,6-dicarboxamide

5-N,6-N-dibenzyl-7-(4-methoxyphenyl)imidazo[1,2-a]pyridine-5,6-dicarboxamide (PubChem CID 121392249) has the molecular formula C30H26N4O3 and a molecular weight of 490.56 g/mol. Its IUPAC name is 5-N,6-N-dibenzyl-7-(4-methoxyphenyl)imidazo[1,2-a]pyridine-5,6-dicarboxamide.

Molecular Properties

Compound Name5-N,6-N-dibenzyl-7-(4-methoxyphenyl)imidazo[1,2-a]pyridine-5,6-dicarboxamide
PubChem CID121392249
Molecular FormulaC30H26N4O3
Molecular Weight490.56 g/mol
Exact Mass490.20
IUPAC Name5-N,6-N-dibenzyl-7-(4-methoxyphenyl)imidazo[1,2-a]pyridine-5,6-dicarboxamide
SMILESCOc1ccc(-c2cc3nccn3c(C(=O)NCc3ccccc3)c2C(=O)NCc2ccccc2)cc1
InChIInChI=1S/C30H26N4O3/c1-37-24-14-12-23(13-15-24)25-18-26-31-16-17-34(26)28(30(36)33-20-22-10-6-3-7-11-22)27(25)29(35)32-19-21-8-4-2-5-9-21/h2-18H,19-20H2,1H3,(H,32,35)(H,33,36)
InChIKeyUBYSPIGZMUUQKG-UHFFFAOYSA-N
XLogP4.87
TPSA84.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms37
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500490.56
LogP ≤ 54.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(4-methoxyphenyl)methyl]imidazo[1,2-a]pyridine-5-carboxamide
CID 110851649
N-benzyl-4-(4-methoxyphenyl)-5-methylthiophene-2-carboxamide
CID 112760256
dimethyl 7-naphthalen-1-ylimidazo[1,2-a]pyridine-5,6-dicarboxylate
CID 145097704
N-benzyl-5-(4-methoxyphenyl)pyridine-3-carboxamide
CID 53020816
N-benzyl-2-(4-methoxyphenyl)-1,3-thiazole-5-carboxamide
CID 117084347
N-benzyl-5-(4-methoxyphenyl)-1,3-oxazole-2-carboxamide
CID 16949912
N-benzyl-2-(4-methoxyphenyl)acetamide
CID 795936
4-(3-methoxyphenyl)-N-[(4-methoxyphenyl)methyl]-2-methylpyridine-3-carboxamide
CID 174823874
N-[(4-methoxyphenyl)methyl]-4-pyridin-4-yl-2-pyrrol-1-ylthiophene-3-carboxamide
CID 20885948
4-(4-methoxyphenyl)-N-(pyridin-3-ylmethyl)pyrimido[5,4-b]indolizine-5-carboxamide
CID 97442209
N-benzyl-7-methoxypyrido[1,2-a]indole-10-carboxamide
CID 66667583
N,1-dibenzyl-3-(4-methoxyphenyl)pyrazole-4-carboxamide
CID 27843936

Frequently Asked Questions

What is the IUPAC name of 5-N,6-N-dibenzyl-7-(4-methoxyphenyl)imidazo[1,2-a]pyridine-5,6-dicarboxamide?
The IUPAC name of 5-N,6-N-dibenzyl-7-(4-methoxyphenyl)imidazo[1,2-a]pyridine-5,6-dicarboxamide (CID 121392249) is 5-N,6-N-dibenzyl-7-(4-methoxyphenyl)imidazo[1,2-a]pyridine-5,6-dicarboxamide.
What is the SMILES notation for 5-N,6-N-dibenzyl-7-(4-methoxyphenyl)imidazo[1,2-a]pyridine-5,6-dicarboxamide?
The canonical SMILES for 5-N,6-N-dibenzyl-7-(4-methoxyphenyl)imidazo[1,2-a]pyridine-5,6-dicarboxamide is COc1ccc(-c2cc3nccn3c(C(=O)NCc3ccccc3)c2C(=O)NCc2ccccc2)cc1.
What is the InChIKey of 5-N,6-N-dibenzyl-7-(4-methoxyphenyl)imidazo[1,2-a]pyridine-5,6-dicarboxamide?
The InChIKey is UBYSPIGZMUUQKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H26N4O3/c1-37-24-14-12-23(13-15-24)25-18-26-31-16-17-34(26)28(30(36)33-20-22-10-6-3-7-11-22)27(25)29(35)32-19-21-8-4-2-5-9-21/h2-18H,19-20H2,1H3,(H,32,35)(H,33,36).
What are the key properties of 5-N,6-N-dibenzyl-7-(4-methoxyphenyl)imidazo[1,2-a]pyridine-5,6-dicarboxamide?
5-N,6-N-dibenzyl-7-(4-methoxyphenyl)imidazo[1,2-a]pyridine-5,6-dicarboxamide has a molecular weight of 490.56 g/mol, XLogP of 4.87, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N,6-N-dibenzyl-7-(4-methoxyphenyl)imidazo[1,2-a]pyridine-5,6-dicarboxamide is sourced from PubChem (CID 121392249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).