2-[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]-N-(6-pyridin-4-yl-3-pyridinyl)acetamide

C24H21N5O — CID 58447768

IUPAC2-[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]-N-(6-pyridin-4-yl-3-pyridinyl)acetamide
SMILESCc1cc(-c2ncc(CC(=O)Nc3ccc(-c4ccncc4)nc3)cc2C)ccn1
InChIInChI=1S/C24H21N5O/c1-16-11-18(14-28-24(16)20-7-10-26-17(2)12-20)13-23(30)29-21-3-4-22(27-15-21)19-5-8-25-9-6-19/h3-12,14-15H,13H2,1-2H3,(H,29,30)
InChIKeyYSJFQTULBGPRRB-UHFFFAOYSA-N
MW395.47 g/mol
LogP4.40
Rot. Bonds5

About 2-[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]-N-(6-pyridin-4-yl-3-pyridinyl)acetamide

2-[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]-N-(6-pyridin-4-yl-3-pyridinyl)acetamide (PubChem CID 58447768) has the molecular formula C24H21N5O and a molecular weight of 395.47 g/mol. Its IUPAC name is 2-[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]-N-(6-pyridin-4-yl-3-pyridinyl)acetamide.

Molecular Properties

Compound Name2-[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]-N-(6-pyridin-4-yl-3-pyridinyl)acetamide
PubChem CID58447768
Molecular FormulaC24H21N5O
Molecular Weight395.47 g/mol
Exact Mass395.17
IUPAC Name2-[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]-N-(6-pyridin-4-yl-3-pyridinyl)acetamide
SMILESCc1cc(-c2ncc(CC(=O)Nc3ccc(-c4ccncc4)nc3)cc2C)ccn1
InChIInChI=1S/C24H21N5O/c1-16-11-18(14-28-24(16)20-7-10-26-17(2)12-20)13-23(30)29-21-3-4-22(27-15-21)19-5-8-25-9-6-19/h3-12,14-15H,13H2,1-2H3,(H,29,30)
InChIKeyYSJFQTULBGPRRB-UHFFFAOYSA-N
XLogP4.40
TPSA80.66 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.47
LogP ≤ 54.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[6-(3-fluorophenyl)-3-pyridinyl]-2-(5-methyl-6-pyridin-4-yl-3-pyridinyl)acetamide;2-[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]-N-[6-(3-methylphenyl)-3-pyridinyl]acetamide;2-(5-methyl-6-pyridin-4-yl-3-pyridinyl)-N-(5-pyridin-2-yl-2-pyridinyl)acetamide;N-(5-pyridin-2-yl-2-pyridinyl)-2-(6-pyridin-4-yl-3-pyridinyl)acetamide
CID 161125461
2-[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]acetamide
CID 149174065
2-[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]-N-[6-[3-methyl-5-(2-oxopropyl)azepan-1-yl]-3-pyridinyl]acetamide
CID 90800421
2-[3-cyano-4-(2-methyl-4-pyridinyl)phenyl]-N-(6-pyrazin-2-yl-3-pyridinyl)acetamide
CID 58447714
N-(6-methyl-3-pyridinyl)-2-pyridin-4-ylacetamide
CID 112532425
2-[6-(4-ethyl-6-methylcyclohepta-1,3,6-trien-1-yl)-5-methyl-3-pyridinyl]-N-[6-(7-methyl-1-azoniabicyclo[4.1.0]hepta-1(6),2,4-trien-3-yl)-3-pyridinyl]acetamide
CID 90982277
N-[4-(2-methyl-4-pyridinyl)phenyl]-2-phenylacetamide
CID 67308361
N-[5-[(3R)-4-acetyl-3-methylpiperazin-1-yl]-2-pyridinyl]-2-[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]acetamide
CID 58447804
2-(4-methylphenyl)-N-(2-methyl-4-pyridinyl)acetamide
CID 110756851
N-(1-hydroxy-5-pyrazin-2-yl-2-pyridinylidene)-2-[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]acetamide
CID 58447790
N-(3,4-dimethylphenyl)-2-pyridin-4-ylacetamide
CID 110697303
3-[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]-1-(3-pyrimidin-2-yl-1H-pyrazol-5-yl)propan-1-one
CID 157430392

Frequently Asked Questions

What is the IUPAC name of 2-[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]-N-(6-pyridin-4-yl-3-pyridinyl)acetamide?
The IUPAC name of 2-[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]-N-(6-pyridin-4-yl-3-pyridinyl)acetamide (CID 58447768) is 2-[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]-N-(6-pyridin-4-yl-3-pyridinyl)acetamide.
What is the SMILES notation for 2-[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]-N-(6-pyridin-4-yl-3-pyridinyl)acetamide?
The canonical SMILES for 2-[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]-N-(6-pyridin-4-yl-3-pyridinyl)acetamide is Cc1cc(-c2ncc(CC(=O)Nc3ccc(-c4ccncc4)nc3)cc2C)ccn1.
What is the InChIKey of 2-[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]-N-(6-pyridin-4-yl-3-pyridinyl)acetamide?
The InChIKey is YSJFQTULBGPRRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21N5O/c1-16-11-18(14-28-24(16)20-7-10-26-17(2)12-20)13-23(30)29-21-3-4-22(27-15-21)19-5-8-25-9-6-19/h3-12,14-15H,13H2,1-2H3,(H,29,30).
What are the key properties of 2-[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]-N-(6-pyridin-4-yl-3-pyridinyl)acetamide?
2-[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]-N-(6-pyridin-4-yl-3-pyridinyl)acetamide has a molecular weight of 395.47 g/mol, XLogP of 4.40, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]-N-(6-pyridin-4-yl-3-pyridinyl)acetamide is sourced from PubChem (CID 58447768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).