2-(4-methylphenyl)-4-pyridin-4-yl-N-(1-pyridin-2-ylethyl)pyrimidine-5-carboxamide

C24H21N5O — CID 53200674

IUPAC2-(4-methylphenyl)-4-pyridin-4-yl-N-(1-pyridin-2-ylethyl)pyrimidine-5-carboxamide
SMILESCc1ccc(-c2ncc(C(=O)NC(C)c3ccccn3)c(-c3ccncc3)n2)cc1
InChIInChI=1S/C24H21N5O/c1-16-6-8-19(9-7-16)23-27-15-20(22(29-23)18-10-13-25-14-11-18)24(30)28-17(2)21-5-3-4-12-26-21/h3-15,17H,1-2H3,(H,28,30)
InChIKeyOWJKAJVENANQSE-UHFFFAOYSA-N
MW395.47 g/mol
LogP4.40
Rot. Bonds5

About 2-(4-methylphenyl)-4-pyridin-4-yl-N-(1-pyridin-2-ylethyl)pyrimidine-5-carboxamide

2-(4-methylphenyl)-4-pyridin-4-yl-N-(1-pyridin-2-ylethyl)pyrimidine-5-carboxamide (PubChem CID 53200674) has the molecular formula C24H21N5O and a molecular weight of 395.47 g/mol. Its IUPAC name is 2-(4-methylphenyl)-4-pyridin-4-yl-N-(1-pyridin-2-ylethyl)pyrimidine-5-carboxamide.

Molecular Properties

Compound Name2-(4-methylphenyl)-4-pyridin-4-yl-N-(1-pyridin-2-ylethyl)pyrimidine-5-carboxamide
PubChem CID53200674
Molecular FormulaC24H21N5O
Molecular Weight395.47 g/mol
Exact Mass395.17
IUPAC Name2-(4-methylphenyl)-4-pyridin-4-yl-N-(1-pyridin-2-ylethyl)pyrimidine-5-carboxamide
SMILESCc1ccc(-c2ncc(C(=O)NC(C)c3ccccn3)c(-c3ccncc3)n2)cc1
InChIInChI=1S/C24H21N5O/c1-16-6-8-19(9-7-16)23-27-15-20(22(29-23)18-10-13-25-14-11-18)24(30)28-17(2)21-5-3-4-12-26-21/h3-15,17H,1-2H3,(H,28,30)
InChIKeyOWJKAJVENANQSE-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

Analyze 2-(4-methylphenyl)-4-pyridin-4-yl-N-(1-pyridin-2-ylethyl)pyrimidine-5-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[1-(4-fluorophenyl)ethyl]-2-phenyl-4-pyridin-4-ylpyrimidine-5-carboxamide
CID 53143559
2-(4-methylphenyl)-N-(2-methylsulfanylphenyl)-4-pyridin-4-ylpyrimidine-5-carboxamide
CID 53143621
3-hydroxy-N-(1-pyridin-2-ylethyl)pyridine-4-carboxamide
CID 81443248
N-(cyclopropylmethyl)-2-(4-methylphenyl)-4-pyridin-4-ylpyrimidine-5-carboxamide
CID 53143618
N-(3-methylphenyl)-2-phenyl-4-pyridin-4-ylpyrimidine-5-carboxamide
CID 53143497
N-(2-fluoro-5-methylphenyl)-2-phenyl-4-pyridin-4-ylpyrimidine-5-carboxamide
CID 53143528
2-(4-fluorophenyl)-N-(2-methylphenyl)-4-pyridin-4-ylpyrimidine-5-carboxamide
CID 53143659
2-(4-methylphenyl)-N-[(1R)-1-pyridin-2-ylethyl]acetamide
CID 25337547
3-hydroxy-2-methyl-N-(1-pyridin-2-ylethyl)benzamide
CID 82829719
2-chloro-N-[(1S)-1-pyridin-2-ylethyl]benzamide
CID 36804802
2-(4-methylphenyl)-4-(4-methylpiperazin-1-yl)-N-(1-phenylethyl)pyrimidine-5-carboxamide
CID 42671005
2-(methylamino)-N-[(1R)-1-pyridin-2-ylethyl]benzamide
CID 81406697

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylphenyl)-4-pyridin-4-yl-N-(1-pyridin-2-ylethyl)pyrimidine-5-carboxamide?
The IUPAC name of 2-(4-methylphenyl)-4-pyridin-4-yl-N-(1-pyridin-2-ylethyl)pyrimidine-5-carboxamide (CID 53200674) is 2-(4-methylphenyl)-4-pyridin-4-yl-N-(1-pyridin-2-ylethyl)pyrimidine-5-carboxamide.
What is the SMILES notation for 2-(4-methylphenyl)-4-pyridin-4-yl-N-(1-pyridin-2-ylethyl)pyrimidine-5-carboxamide?
The canonical SMILES for 2-(4-methylphenyl)-4-pyridin-4-yl-N-(1-pyridin-2-ylethyl)pyrimidine-5-carboxamide is Cc1ccc(-c2ncc(C(=O)NC(C)c3ccccn3)c(-c3ccncc3)n2)cc1.
What is the InChIKey of 2-(4-methylphenyl)-4-pyridin-4-yl-N-(1-pyridin-2-ylethyl)pyrimidine-5-carboxamide?
The InChIKey is OWJKAJVENANQSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21N5O/c1-16-6-8-19(9-7-16)23-27-15-20(22(29-23)18-10-13-25-14-11-18)24(30)28-17(2)21-5-3-4-12-26-21/h3-15,17H,1-2H3,(H,28,30).
What are the key properties of 2-(4-methylphenyl)-4-pyridin-4-yl-N-(1-pyridin-2-ylethyl)pyrimidine-5-carboxamide?
2-(4-methylphenyl)-4-pyridin-4-yl-N-(1-pyridin-2-ylethyl)pyrimidine-5-carboxamide 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-(4-methylphenyl)-4-pyridin-4-yl-N-(1-pyridin-2-ylethyl)pyrimidine-5-carboxamide is sourced from PubChem (CID 53200674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).