2-[(6-ethyl-2-pyridin-2-ylpyrimidin-4-yl)amino]-N-phenylpropanamide

C20H21N5O — CID 133311048

IUPAC2-[(6-ethyl-2-pyridin-2-ylpyrimidin-4-yl)amino]-N-phenylpropanamide
SMILESCCc1cc(NC(C)C(=O)Nc2ccccc2)nc(-c2ccccn2)n1
InChIInChI=1S/C20H21N5O/c1-3-15-13-18(25-19(23-15)17-11-7-8-12-21-17)22-14(2)20(26)24-16-9-5-4-6-10-16/h4-14H,3H2,1-2H3,(H,24,26)(H,22,23,25)
InChIKeyUZEWBQVZQJDRFE-UHFFFAOYSA-N
MW347.42 g/mol
LogP3.54
Rot. Bonds6

About 2-[(6-ethyl-2-pyridin-2-ylpyrimidin-4-yl)amino]-N-phenylpropanamide

2-[(6-ethyl-2-pyridin-2-ylpyrimidin-4-yl)amino]-N-phenylpropanamide (PubChem CID 133311048) has the molecular formula C20H21N5O and a molecular weight of 347.42 g/mol. Its IUPAC name is 2-[(6-ethyl-2-pyridin-2-ylpyrimidin-4-yl)amino]-N-phenylpropanamide.

Molecular Properties

Compound Name2-[(6-ethyl-2-pyridin-2-ylpyrimidin-4-yl)amino]-N-phenylpropanamide
PubChem CID133311048
Molecular FormulaC20H21N5O
Molecular Weight347.42 g/mol
Exact Mass347.17
IUPAC Name2-[(6-ethyl-2-pyridin-2-ylpyrimidin-4-yl)amino]-N-phenylpropanamide
SMILESCCc1cc(NC(C)C(=O)Nc2ccccc2)nc(-c2ccccn2)n1
InChIInChI=1S/C20H21N5O/c1-3-15-13-18(25-19(23-15)17-11-7-8-12-21-17)22-14(2)20(26)24-16-9-5-4-6-10-16/h4-14H,3H2,1-2H3,(H,24,26)(H,22,23,25)
InChIKeyUZEWBQVZQJDRFE-UHFFFAOYSA-N
XLogP3.54
TPSA79.80 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.42
LogP ≤ 53.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-[(6-ethyl-2-pyridin-2-ylpyrimidin-4-yl)amino]-N-phenylpropanamide 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

6-ethyl-N-methyl-2-pyridin-2-ylpyrimidin-4-amine
CID 62191102
N-[3-[(6-ethyl-2-pyridin-2-ylpyrimidin-4-yl)amino]phenyl]cyclopropanecarboxamide
CID 133290845
methyl N-[4-[(6-ethyl-2-pyridin-2-ylpyrimidin-4-yl)amino]phenyl]-N-methylcarbamate
CID 91642537
6-ethyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]-2-pyridin-2-ylpyrimidin-4-amine
CID 133294382
6-(propan-2-ylamino)-2-pyridin-2-ylpyrimidine-4-carboxylic acid
CID 82169893
6-ethyl-2-pyridin-2-yl-N-(1-thiophen-2-ylpropyl)pyrimidin-4-amine
CID 133336468
N-phenyl-2-(pyrazin-2-ylamino)propanamide
CID 133311086
6-ethyl-N-[1-(oxolan-3-yloxy)propan-2-yl]-2-pyridin-2-ylpyrimidin-4-amine
CID 133348443
2-[(1-chloroisoquinolin-3-yl)amino]-N-phenylpropanamide
CID 133310982
6-ethyl-N-[(2-pyrazol-1-yl-3-pyridinyl)methyl]-2-pyridin-2-ylpyrimidin-4-amine
CID 133291049
N-phenyl-2-(2-pyridin-2-ylethylamino)propanamide
CID 43083637
N-butan-2-yl-2-[(6-ethyl-2-pyridin-4-ylpyrimidin-4-yl)amino]propanamide
CID 56785557

Frequently Asked Questions

What is the IUPAC name of 2-[(6-ethyl-2-pyridin-2-ylpyrimidin-4-yl)amino]-N-phenylpropanamide?
The IUPAC name of 2-[(6-ethyl-2-pyridin-2-ylpyrimidin-4-yl)amino]-N-phenylpropanamide (CID 133311048) is 2-[(6-ethyl-2-pyridin-2-ylpyrimidin-4-yl)amino]-N-phenylpropanamide.
What is the SMILES notation for 2-[(6-ethyl-2-pyridin-2-ylpyrimidin-4-yl)amino]-N-phenylpropanamide?
The canonical SMILES for 2-[(6-ethyl-2-pyridin-2-ylpyrimidin-4-yl)amino]-N-phenylpropanamide is CCc1cc(NC(C)C(=O)Nc2ccccc2)nc(-c2ccccn2)n1.
What is the InChIKey of 2-[(6-ethyl-2-pyridin-2-ylpyrimidin-4-yl)amino]-N-phenylpropanamide?
The InChIKey is UZEWBQVZQJDRFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N5O/c1-3-15-13-18(25-19(23-15)17-11-7-8-12-21-17)22-14(2)20(26)24-16-9-5-4-6-10-16/h4-14H,3H2,1-2H3,(H,24,26)(H,22,23,25).
What are the key properties of 2-[(6-ethyl-2-pyridin-2-ylpyrimidin-4-yl)amino]-N-phenylpropanamide?
2-[(6-ethyl-2-pyridin-2-ylpyrimidin-4-yl)amino]-N-phenylpropanamide has a molecular weight of 347.42 g/mol, XLogP of 3.54, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-ethyl-2-pyridin-2-ylpyrimidin-4-yl)amino]-N-phenylpropanamide is sourced from PubChem (CID 133311048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).