6-[methyl-(2-oxo-2-piperidin-1-ylethyl)amino]-2-morpholin-4-ylpyrimidine-4-carboxylic acid

C17H25N5O4 — CID 68516488

IUPAC6-[methyl-(2-oxo-2-piperidin-1-ylethyl)amino]-2-morpholin-4-ylpyrimidine-4-carboxylic acid
SMILESCN(CC(=O)N1CCCCC1)c1cc(C(=O)O)nc(N2CCOCC2)n1
InChIInChI=1S/C17H25N5O4/c1-20(12-15(23)21-5-3-2-4-6-21)14-11-13(16(24)25)18-17(19-14)22-7-9-26-10-8-22/h11H,2-10,12H2,1H3,(H,24,25)
InChIKeyNAZPHCGNVRFVKB-UHFFFAOYSA-N
MW363.42 g/mol
LogP0.46
Rot. Bonds5

About 6-[methyl-(2-oxo-2-piperidin-1-ylethyl)amino]-2-morpholin-4-ylpyrimidine-4-carboxylic acid

6-[methyl-(2-oxo-2-piperidin-1-ylethyl)amino]-2-morpholin-4-ylpyrimidine-4-carboxylic acid (PubChem CID 68516488) has the molecular formula C17H25N5O4 and a molecular weight of 363.42 g/mol. Its IUPAC name is 6-[methyl-(2-oxo-2-piperidin-1-ylethyl)amino]-2-morpholin-4-ylpyrimidine-4-carboxylic acid.

Molecular Properties

Compound Name6-[methyl-(2-oxo-2-piperidin-1-ylethyl)amino]-2-morpholin-4-ylpyrimidine-4-carboxylic acid
PubChem CID68516488
Molecular FormulaC17H25N5O4
Molecular Weight363.42 g/mol
Exact Mass363.19
IUPAC Name6-[methyl-(2-oxo-2-piperidin-1-ylethyl)amino]-2-morpholin-4-ylpyrimidine-4-carboxylic acid
SMILESCN(CC(=O)N1CCCCC1)c1cc(C(=O)O)nc(N2CCOCC2)n1
InChIInChI=1S/C17H25N5O4/c1-20(12-15(23)21-5-3-2-4-6-21)14-11-13(16(24)25)18-17(19-14)22-7-9-26-10-8-22/h11H,2-10,12H2,1H3,(H,24,25)
InChIKeyNAZPHCGNVRFVKB-UHFFFAOYSA-N
XLogP0.46
TPSA99.10 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.42
LogP ≤ 50.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 6-[methyl-(2-oxo-2-piperidin-1-ylethyl)amino]-2-morpholin-4-ylpyrimidine-4-carboxylic acid 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-(2,3-dimethyl-1H-indol-5-yl)-6-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]-2-morpholin-4-ylpyrimidine-4-carboxamide
CID 59258718
6-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]pyridine-2-carboxylic acid
CID 122053743
2-methyl-4-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)amino]-1H-pyrimidin-6-one
CID 136957593
2-piperidin-1-ylpyrimidine-4,6-dicarboxylic acid
CID 66490570
2-[(6-chloro-2-ethylpyrimidin-4-yl)-methylamino]-1-pyrrolidin-1-ylethanone
CID 80936172
2-[[6-amino-2-(trifluoromethyl)pyrimidin-4-yl]-methylamino]-1-pyrrolidin-1-ylethanone
CID 106771112
2-[[2-amino-6-(ethylamino)pyrimidin-4-yl]-methylamino]-1-pyrrolidin-1-ylethanone
CID 80799693
methyl 6-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)amino]pyrazine-2-carboxylate
CID 66457852
6-chloro-2-piperidin-1-ylpyrimidine-4-carboxylic acid
CID 83852710
N-(4-bromo-3-methylphenyl)-6-[2-methoxyethyl(methyl)amino]-2-morpholin-4-ylpyrimidine-4-carboxamide
CID 59258645
6-[2-methoxyethyl(methyl)amino]-N-(2-methylquinolin-6-yl)-2-morpholin-4-ylpyrimidine-4-carboxamide
CID 59258570
6-methyl-2-morpholin-4-ylpyrimidine-4-carboxamide
CID 1480862

Frequently Asked Questions

What is the IUPAC name of 6-[methyl-(2-oxo-2-piperidin-1-ylethyl)amino]-2-morpholin-4-ylpyrimidine-4-carboxylic acid?
The IUPAC name of 6-[methyl-(2-oxo-2-piperidin-1-ylethyl)amino]-2-morpholin-4-ylpyrimidine-4-carboxylic acid (CID 68516488) is 6-[methyl-(2-oxo-2-piperidin-1-ylethyl)amino]-2-morpholin-4-ylpyrimidine-4-carboxylic acid.
What is the SMILES notation for 6-[methyl-(2-oxo-2-piperidin-1-ylethyl)amino]-2-morpholin-4-ylpyrimidine-4-carboxylic acid?
The canonical SMILES for 6-[methyl-(2-oxo-2-piperidin-1-ylethyl)amino]-2-morpholin-4-ylpyrimidine-4-carboxylic acid is CN(CC(=O)N1CCCCC1)c1cc(C(=O)O)nc(N2CCOCC2)n1.
What is the InChIKey of 6-[methyl-(2-oxo-2-piperidin-1-ylethyl)amino]-2-morpholin-4-ylpyrimidine-4-carboxylic acid?
The InChIKey is NAZPHCGNVRFVKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N5O4/c1-20(12-15(23)21-5-3-2-4-6-21)14-11-13(16(24)25)18-17(19-14)22-7-9-26-10-8-22/h11H,2-10,12H2,1H3,(H,24,25).
What are the key properties of 6-[methyl-(2-oxo-2-piperidin-1-ylethyl)amino]-2-morpholin-4-ylpyrimidine-4-carboxylic acid?
6-[methyl-(2-oxo-2-piperidin-1-ylethyl)amino]-2-morpholin-4-ylpyrimidine-4-carboxylic acid has a molecular weight of 363.42 g/mol, XLogP of 0.46, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[methyl-(2-oxo-2-piperidin-1-ylethyl)amino]-2-morpholin-4-ylpyrimidine-4-carboxylic acid is sourced from PubChem (CID 68516488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).