4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-(pyridin-2-ylmethyl)benzamide

C56H48N8O2 — CID 123387373

IUPAC4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-(pyridin-2-ylmethyl)benzamide
SMILESCc1ccc(C(=O)Nc2ccc(-c3cn4cccc(C)c4n3)cc2)c(Cc2ccccn2)c1.Cc1ccc(C(=O)Nc2ccc(-c3cn4cccc(C)c4n3)cc2)c(Cc2ccccn2)c1
InChIInChI=1S/2C28H24N4O/c2*1-19-8-13-25(22(16-19)17-24-7-3-4-14-29-24)28(33)30-23-11-9-21(10-12-23)26-18-32-15-5-6-20(2)27(32)31-26/h2*3-16,18H,17H2,1-2H3,(H,30,33)
InChIKeyUJUZTIVUYDMPOG-UHFFFAOYSA-N
MW865.05 g/mol
LogP11.71
Rot. Bonds10

About 4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-(pyridin-2-ylmethyl)benzamide

4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-(pyridin-2-ylmethyl)benzamide (PubChem CID 123387373) has the molecular formula C56H48N8O2 and a molecular weight of 865.05 g/mol. Its IUPAC name is 4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-(pyridin-2-ylmethyl)benzamide.

Molecular Properties

Compound Name4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-(pyridin-2-ylmethyl)benzamide
PubChem CID123387373
Molecular FormulaC56H48N8O2
Molecular Weight865.05 g/mol
Exact Mass864.39
IUPAC Name4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-(pyridin-2-ylmethyl)benzamide
SMILESCc1ccc(C(=O)Nc2ccc(-c3cn4cccc(C)c4n3)cc2)c(Cc2ccccn2)c1.Cc1ccc(C(=O)Nc2ccc(-c3cn4cccc(C)c4n3)cc2)c(Cc2ccccn2)c1
InChIInChI=1S/2C28H24N4O/c2*1-19-8-13-25(22(16-19)17-24-7-3-4-14-29-24)28(33)30-23-11-9-21(10-12-23)26-18-32-15-5-6-20(2)27(32)31-26/h2*3-16,18H,17H2,1-2H3,(H,30,33)
InChIKeyUJUZTIVUYDMPOG-UHFFFAOYSA-N
XLogP11.71
TPSA118.58 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds10
Heavy Atoms66
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500865.05
LogP ≤ 511.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-(pyridin-2-ylmethyl)benzamide?
The IUPAC name of 4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-(pyridin-2-ylmethyl)benzamide (CID 123387373) is 4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-(pyridin-2-ylmethyl)benzamide.
What is the SMILES notation for 4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-(pyridin-2-ylmethyl)benzamide?
The canonical SMILES for 4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-(pyridin-2-ylmethyl)benzamide is Cc1ccc(C(=O)Nc2ccc(-c3cn4cccc(C)c4n3)cc2)c(Cc2ccccn2)c1.Cc1ccc(C(=O)Nc2ccc(-c3cn4cccc(C)c4n3)cc2)c(Cc2ccccn2)c1.
What is the InChIKey of 4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-(pyridin-2-ylmethyl)benzamide?
The InChIKey is UJUZTIVUYDMPOG-UHFFFAOYSA-N. The full InChI is InChI=1S/2C28H24N4O/c2*1-19-8-13-25(22(16-19)17-24-7-3-4-14-29-24)28(33)30-23-11-9-21(10-12-23)26-18-32-15-5-6-20(2)27(32)31-26/h2*3-16,18H,17H2,1-2H3,(H,30,33).
What are the key properties of 4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-(pyridin-2-ylmethyl)benzamide?
4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-(pyridin-2-ylmethyl)benzamide has a molecular weight of 865.05 g/mol, XLogP of 11.71, 10 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-(pyridin-2-ylmethyl)benzamide is sourced from PubChem (CID 123387373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).