4-hydroxy-1-(6-methoxy-5-methylpyrimidin-4-yl)pyrrolidine-2-carboxylic acid

C11H15N3O4 — CID 66333746

IUPAC4-hydroxy-1-(6-methoxy-5-methylpyrimidin-4-yl)pyrrolidine-2-carboxylic acid
SMILESCOc1ncnc(N2CC(O)CC2C(=O)O)c1C
InChIInChI=1S/C11H15N3O4/c1-6-9(12-5-13-10(6)18-2)14-4-7(15)3-8(14)11(16)17/h5,7-8,15H,3-4H2,1-2H3,(H,16,17)
InChIKeyYSVNGBBXMOHTPZ-UHFFFAOYSA-N
MW253.26 g/mol
LogP-0.18
Rot. Bonds3

About 4-hydroxy-1-(6-methoxy-5-methylpyrimidin-4-yl)pyrrolidine-2-carboxylic acid

4-hydroxy-1-(6-methoxy-5-methylpyrimidin-4-yl)pyrrolidine-2-carboxylic acid (PubChem CID 66333746) has the molecular formula C11H15N3O4 and a molecular weight of 253.26 g/mol. Its IUPAC name is 4-hydroxy-1-(6-methoxy-5-methylpyrimidin-4-yl)pyrrolidine-2-carboxylic acid.

Molecular Properties

Compound Name4-hydroxy-1-(6-methoxy-5-methylpyrimidin-4-yl)pyrrolidine-2-carboxylic acid
PubChem CID66333746
Molecular FormulaC11H15N3O4
Molecular Weight253.26 g/mol
Exact Mass253.11
IUPAC Name4-hydroxy-1-(6-methoxy-5-methylpyrimidin-4-yl)pyrrolidine-2-carboxylic acid
SMILESCOc1ncnc(N2CC(O)CC2C(=O)O)c1C
InChIInChI=1S/C11H15N3O4/c1-6-9(12-5-13-10(6)18-2)14-4-7(15)3-8(14)11(16)17/h5,7-8,15H,3-4H2,1-2H3,(H,16,17)
InChIKeyYSVNGBBXMOHTPZ-UHFFFAOYSA-N
XLogP-0.18
TPSA95.78 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.26
LogP ≤ 5-0.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 4-hydroxy-1-(6-methoxy-5-methylpyrimidin-4-yl)pyrrolidine-2-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

2-[1-(6-methoxy-5-methylpyrimidin-4-yl)piperidin-3-yl]acetic acid
CID 66332132
4-(3,5-dimethylpiperazin-1-yl)-6-methoxy-5-methylpyrimidine
CID 66331134
4-hydroxy-1-(4-methylpyrimidin-2-yl)pyrrolidine-2-carboxylic acid
CID 62959062
2-[8-(6-methoxy-5-methylpyrimidin-4-yl)-8-azabicyclo[3.2.1]octan-3-yl]acetic acid
CID 79610370
[1-(6-methoxy-5-methylpyrimidin-4-yl)azetidin-3-yl]methanamine
CID 66325530
1-(6-ethoxy-5-methylpyrimidin-4-yl)-4-methylpyrrolidine-3-carboxylic acid
CID 66325534
(2S,4R)-4-hydroxy-1-(2-methoxypyridine-3-carbonyl)pyrrolidine-2-carboxylic acid
CID 55259968
(2R,4S)-4-hydroxy-1-(6-methyl-3-nitro-2-pyridinyl)pyrrolidine-2-carboxylic acid
CID 95987380
1-(6-methoxy-5-methylpyrimidin-4-yl)-3-propan-2-ylpyrrolidine-3-carboxylic acid
CID 106982984
4-hydroxy-1-[3-(trifluoromethyl)-2-pyridinyl]pyrrolidine-2-carboxylic acid
CID 16794593
1-(6-methoxy-5-methylpyrimidin-4-yl)-N-methylpiperidin-3-amine
CID 66332559
4-hydroxy-1-(5-methyl-4-nitro-2-pyridinyl)pyrrolidine-2-carboxylic acid
CID 83267948

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-1-(6-methoxy-5-methylpyrimidin-4-yl)pyrrolidine-2-carboxylic acid?
The IUPAC name of 4-hydroxy-1-(6-methoxy-5-methylpyrimidin-4-yl)pyrrolidine-2-carboxylic acid (CID 66333746) is 4-hydroxy-1-(6-methoxy-5-methylpyrimidin-4-yl)pyrrolidine-2-carboxylic acid.
What is the SMILES notation for 4-hydroxy-1-(6-methoxy-5-methylpyrimidin-4-yl)pyrrolidine-2-carboxylic acid?
The canonical SMILES for 4-hydroxy-1-(6-methoxy-5-methylpyrimidin-4-yl)pyrrolidine-2-carboxylic acid is COc1ncnc(N2CC(O)CC2C(=O)O)c1C.
What is the InChIKey of 4-hydroxy-1-(6-methoxy-5-methylpyrimidin-4-yl)pyrrolidine-2-carboxylic acid?
The InChIKey is YSVNGBBXMOHTPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O4/c1-6-9(12-5-13-10(6)18-2)14-4-7(15)3-8(14)11(16)17/h5,7-8,15H,3-4H2,1-2H3,(H,16,17).
What are the key properties of 4-hydroxy-1-(6-methoxy-5-methylpyrimidin-4-yl)pyrrolidine-2-carboxylic acid?
4-hydroxy-1-(6-methoxy-5-methylpyrimidin-4-yl)pyrrolidine-2-carboxylic acid has a molecular weight of 253.26 g/mol, XLogP of -0.18, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-1-(6-methoxy-5-methylpyrimidin-4-yl)pyrrolidine-2-carboxylic acid is sourced from PubChem (CID 66333746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).