N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide

C21H25N5O3 — CID 122353699

IUPACN-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide
SMILESCc1cc(CNC(=O)C2CC(=O)N(c3ccccc3)C2)nc(N2CCOCC2)n1
InChIInChI=1S/C21H25N5O3/c1-15-11-17(24-21(23-15)25-7-9-29-10-8-25)13-22-20(28)16-12-19(27)26(14-16)18-5-3-2-4-6-18/h2-6,11,16H,7-10,12-14H2,1H3,(H,22,28)
InChIKeyLXYYFOWWCSKCGZ-UHFFFAOYSA-N
MW395.46 g/mol
LogP1.29
Rot. Bonds5

About N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide

N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide (PubChem CID 122353699) has the molecular formula C21H25N5O3 and a molecular weight of 395.46 g/mol. Its IUPAC name is N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide
PubChem CID122353699
Molecular FormulaC21H25N5O3
Molecular Weight395.46 g/mol
Exact Mass395.20
IUPAC NameN-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide
SMILESCc1cc(CNC(=O)C2CC(=O)N(c3ccccc3)C2)nc(N2CCOCC2)n1
InChIInChI=1S/C21H25N5O3/c1-15-11-17(24-21(23-15)25-7-9-29-10-8-25)13-22-20(28)16-12-19(27)26(14-16)18-5-3-2-4-6-18/h2-6,11,16H,7-10,12-14H2,1H3,(H,22,28)
InChIKeyLXYYFOWWCSKCGZ-UHFFFAOYSA-N
XLogP1.29
TPSA87.66 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.46
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]-5-oxo-1-phenylpyrrolidine-3-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

1-(4-methylphenyl)-N-[(6-methyl-2-piperidin-1-ylpyrimidin-4-yl)methyl]-5-oxopyrrolidine-3-carboxamide
CID 122352811
1-(4-methoxyphenyl)-N-[(4-methyl-6-morpholin-4-ylpyrimidin-2-yl)methyl]-5-oxopyrrolidine-3-carboxamide
CID 122319052
1-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]-3-phenylurea
CID 91967530
2-chloro-N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]benzamide
CID 72718377
N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]-3-phenylpropanamide
CID 91967478
1-(4-chlorophenyl)-N-[2-[(4-methyl-6-morpholin-4-ylpyrimidin-2-yl)amino]ethyl]-5-oxopyrrolidine-3-carboxamide
CID 122295155
1-(2-morpholin-4-ylphenyl)-5-oxo-N-(pyridin-2-ylmethyl)pyrrolidine-3-carboxamide
CID 113189989
1-(3-methoxyphenyl)-N-[(4-morpholin-4-ylpyrimidin-2-yl)methyl]-5-oxopyrrolidine-3-carboxamide
CID 122318776
N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]-2-(3-methylphenyl)acetamide
CID 122353695
(3S)-1-(4-methylphenyl)-5-oxo-N-[(5-phenyl-1,2-oxazol-3-yl)methyl]pyrrolidine-3-carboxamide
CID 42477859
(3S)-N-[(2-methylphenyl)methyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide
CID 40978837
N-[(3-methylphenyl)methyl]-1-(2-morpholin-4-ylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 113189983

Frequently Asked Questions

What is the IUPAC name of N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide?
The IUPAC name of N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide (CID 122353699) is N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide.
What is the SMILES notation for N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide?
The canonical SMILES for N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide is Cc1cc(CNC(=O)C2CC(=O)N(c3ccccc3)C2)nc(N2CCOCC2)n1.
What is the InChIKey of N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide?
The InChIKey is LXYYFOWWCSKCGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N5O3/c1-15-11-17(24-21(23-15)25-7-9-29-10-8-25)13-22-20(28)16-12-19(27)26(14-16)18-5-3-2-4-6-18/h2-6,11,16H,7-10,12-14H2,1H3,(H,22,28).
What are the key properties of N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide?
N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide has a molecular weight of 395.46 g/mol, XLogP of 1.29, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)methyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide is sourced from PubChem (CID 122353699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).