5-hydroxy-1-methyl-N-(1,2-oxazol-4-yl)-6-oxo-2-[1-(1-phenylethyl)piperidin-3-yl]pyrimidine-4-carboxamide

C22H25N5O4 — CID 172693364

IUPAC5-hydroxy-1-methyl-N-(1,2-oxazol-4-yl)-6-oxo-2-[1-(1-phenylethyl)piperidin-3-yl]pyrimidine-4-carboxamide
SMILESCC(c1ccccc1)N1CCCC(c2nc(C(=O)Nc3cnoc3)c(O)c(=O)n2C)C1
InChIInChI=1S/C22H25N5O4/c1-14(15-7-4-3-5-8-15)27-10-6-9-16(12-27)20-25-18(19(28)22(30)26(20)2)21(29)24-17-11-23-31-13-17/h3-5,7-8,11,13-14,16,28H,6,9-10,12H2,1-2H3,(H,24,29)
InChIKeyBZFPAMAIRKBGAI-UHFFFAOYSA-N
MW423.47 g/mol
LogP2.67
Rot. Bonds5

About 5-hydroxy-1-methyl-N-(1,2-oxazol-4-yl)-6-oxo-2-[1-(1-phenylethyl)piperidin-3-yl]pyrimidine-4-carboxamide

5-hydroxy-1-methyl-N-(1,2-oxazol-4-yl)-6-oxo-2-[1-(1-phenylethyl)piperidin-3-yl]pyrimidine-4-carboxamide (PubChem CID 172693364) has the molecular formula C22H25N5O4 and a molecular weight of 423.47 g/mol. Its IUPAC name is 5-hydroxy-1-methyl-N-(1,2-oxazol-4-yl)-6-oxo-2-[1-(1-phenylethyl)piperidin-3-yl]pyrimidine-4-carboxamide.

Molecular Properties

Compound Name5-hydroxy-1-methyl-N-(1,2-oxazol-4-yl)-6-oxo-2-[1-(1-phenylethyl)piperidin-3-yl]pyrimidine-4-carboxamide
PubChem CID172693364
Molecular FormulaC22H25N5O4
Molecular Weight423.47 g/mol
Exact Mass423.19
IUPAC Name5-hydroxy-1-methyl-N-(1,2-oxazol-4-yl)-6-oxo-2-[1-(1-phenylethyl)piperidin-3-yl]pyrimidine-4-carboxamide
SMILESCC(c1ccccc1)N1CCCC(c2nc(C(=O)Nc3cnoc3)c(O)c(=O)n2C)C1
InChIInChI=1S/C22H25N5O4/c1-14(15-7-4-3-5-8-15)27-10-6-9-16(12-27)20-25-18(19(28)22(30)26(20)2)21(29)24-17-11-23-31-13-17/h3-5,7-8,11,13-14,16,28H,6,9-10,12H2,1-2H3,(H,24,29)
InChIKeyBZFPAMAIRKBGAI-UHFFFAOYSA-N
XLogP2.67
TPSA113.49 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500423.47
LogP ≤ 52.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze 5-hydroxy-1-methyl-N-(1,2-oxazol-4-yl)-6-oxo-2-[1-(1-phenylethyl)piperidin-3-yl]pyrimidine-4-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

2-(1-benzylpiperidin-3-yl)-5-hydroxy-1-methyl-N-(1,2-oxazol-4-yl)-6-oxopyrimidine-4-carboxamide
CID 146665364
2-[1-(4-chlorobenzoyl)piperidin-3-yl]-5-hydroxy-1-methyl-N-(1,2-oxazol-4-yl)-6-oxopyrimidine-4-carboxamide
CID 146665378
5-hydroxy-1-methyl-N-(1,2-oxazol-4-yl)-6-oxo-2-pyridin-2-ylpyrimidine-4-carboxamide
CID 146664900
2-[1-(2-cyanophenyl)-1-(2,5-dimethylpyrazol-3-yl)propan-2-yl]-5-hydroxy-1-methyl-N-(1,2-oxazol-4-yl)-6-oxopyrimidine-4-carboxamide
CID 166100283
2-[1-(2-cyanophenyl)-1-(3,5-dimethylpyrazin-2-yl)propan-2-yl]-5-hydroxy-1-methyl-N-(1,2-oxazol-4-yl)-6-oxopyrimidine-4-carboxamide
CID 166100173
2-[(1R,2S)-1-(2-cyanophenyl)-1-(3,5-difluorophenyl)propan-2-yl]-5-hydroxy-1-methyl-N-(1,2-oxazol-4-yl)-6-oxopyrimidine-4-carboxamide
CID 170945485
2-[5-hydroxy-1-methyl-4-(1,2-oxazol-4-ylcarbamoyl)-6-oxopyrimidin-2-yl]-N,N-dimethyl-1-phenyl-3,4-dihydro-1H-isoquinoline-7-carboxamide
CID 170645924
2-[(1S,2R)-1-(2-chlorophenyl)-1-(5-methylpyrazin-2-yl)propan-2-yl]-5-hydroxy-1-methyl-N-(1,2-oxazol-4-yl)-6-oxopyrimidine-4-carboxamide
CID 170944321
5-hydroxy-1-methyl-2-[methyl(pyridin-2-ylmethyl)amino]-N-(1,2-oxazol-4-yl)-6-oxopyrimidine-4-carboxamide
CID 155590513
2-[(1R,2R)-1-(2-cyanophenyl)-1-(1-methyl-1,2,4-triazol-3-yl)propan-2-yl]-5-hydroxy-1-methyl-N-(1,2-oxazol-4-yl)-6-oxopyrimidine-4-carboxamide
CID 170944353
2-[(1R,2S)-1-(3-cyano-1-methylpyrazol-4-yl)-1-(2-cyanophenyl)propan-2-yl]-5-hydroxy-1-methyl-N-(1,2-oxazol-4-yl)-6-oxopyrimidine-4-carboxamide
CID 170944502
2-[(1R,2S)-1-(2-cyanophenyl)-1-[1-(2-piperazin-1-ylethyl)pyrazol-4-yl]propan-2-yl]-5-hydroxy-1-methyl-N-(1,2-oxazol-4-yl)-6-oxopyrimidine-4-carboxamide
CID 170944715

Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-1-methyl-N-(1,2-oxazol-4-yl)-6-oxo-2-[1-(1-phenylethyl)piperidin-3-yl]pyrimidine-4-carboxamide?
The IUPAC name of 5-hydroxy-1-methyl-N-(1,2-oxazol-4-yl)-6-oxo-2-[1-(1-phenylethyl)piperidin-3-yl]pyrimidine-4-carboxamide (CID 172693364) is 5-hydroxy-1-methyl-N-(1,2-oxazol-4-yl)-6-oxo-2-[1-(1-phenylethyl)piperidin-3-yl]pyrimidine-4-carboxamide.
What is the SMILES notation for 5-hydroxy-1-methyl-N-(1,2-oxazol-4-yl)-6-oxo-2-[1-(1-phenylethyl)piperidin-3-yl]pyrimidine-4-carboxamide?
The canonical SMILES for 5-hydroxy-1-methyl-N-(1,2-oxazol-4-yl)-6-oxo-2-[1-(1-phenylethyl)piperidin-3-yl]pyrimidine-4-carboxamide is CC(c1ccccc1)N1CCCC(c2nc(C(=O)Nc3cnoc3)c(O)c(=O)n2C)C1.
What is the InChIKey of 5-hydroxy-1-methyl-N-(1,2-oxazol-4-yl)-6-oxo-2-[1-(1-phenylethyl)piperidin-3-yl]pyrimidine-4-carboxamide?
The InChIKey is BZFPAMAIRKBGAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25N5O4/c1-14(15-7-4-3-5-8-15)27-10-6-9-16(12-27)20-25-18(19(28)22(30)26(20)2)21(29)24-17-11-23-31-13-17/h3-5,7-8,11,13-14,16,28H,6,9-10,12H2,1-2H3,(H,24,29).
What are the key properties of 5-hydroxy-1-methyl-N-(1,2-oxazol-4-yl)-6-oxo-2-[1-(1-phenylethyl)piperidin-3-yl]pyrimidine-4-carboxamide?
5-hydroxy-1-methyl-N-(1,2-oxazol-4-yl)-6-oxo-2-[1-(1-phenylethyl)piperidin-3-yl]pyrimidine-4-carboxamide has a molecular weight of 423.47 g/mol, XLogP of 2.67, 5 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-1-methyl-N-(1,2-oxazol-4-yl)-6-oxo-2-[1-(1-phenylethyl)piperidin-3-yl]pyrimidine-4-carboxamide is sourced from PubChem (CID 172693364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).