6-methyl-4-oxo-3H-furo[2,3-d]pyrimidine-5-carboxylic acid

C8H6N2O4 — CID 4962030

IUPAC6-methyl-4-oxo-3H-furo[2,3-d]pyrimidine-5-carboxylic acid
SMILESCc1oc2nc[nH]c(=O)c2c1C(=O)O
InChIInChI=1S/C8H6N2O4/c1-3-4(8(12)13)5-6(11)9-2-10-7(5)14-3/h2H,1H3,(H,12,13)(H,9,10,11)
InChIKeyFUUXILGTYMNJST-UHFFFAOYSA-N
MW194.15 g/mol
LogP0.52
Rot. Bonds1

About 6-methyl-4-oxo-3H-furo[2,3-d]pyrimidine-5-carboxylic acid

6-methyl-4-oxo-3H-furo[2,3-d]pyrimidine-5-carboxylic acid (PubChem CID 4962030) has the molecular formula C8H6N2O4 and a molecular weight of 194.15 g/mol. Its IUPAC name is 6-methyl-4-oxo-3H-furo[2,3-d]pyrimidine-5-carboxylic acid.

Molecular Properties

Compound Name6-methyl-4-oxo-3H-furo[2,3-d]pyrimidine-5-carboxylic acid
PubChem CID4962030
Molecular FormulaC8H6N2O4
Molecular Weight194.15 g/mol
Exact Mass194.03
IUPAC Name6-methyl-4-oxo-3H-furo[2,3-d]pyrimidine-5-carboxylic acid
SMILESCc1oc2nc[nH]c(=O)c2c1C(=O)O
InChIInChI=1S/C8H6N2O4/c1-3-4(8(12)13)5-6(11)9-2-10-7(5)14-3/h2H,1H3,(H,12,13)(H,9,10,11)
InChIKeyFUUXILGTYMNJST-UHFFFAOYSA-N
XLogP0.52
TPSA96.19 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.15
LogP ≤ 50.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 6-methyl-4-oxo-3H-furo[2,3-d]pyrimidine-5-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

Frequently Asked Questions

What is the IUPAC name of 6-methyl-4-oxo-3H-furo[2,3-d]pyrimidine-5-carboxylic acid?
The IUPAC name of 6-methyl-4-oxo-3H-furo[2,3-d]pyrimidine-5-carboxylic acid (CID 4962030) is 6-methyl-4-oxo-3H-furo[2,3-d]pyrimidine-5-carboxylic acid.
What is the SMILES notation for 6-methyl-4-oxo-3H-furo[2,3-d]pyrimidine-5-carboxylic acid?
The canonical SMILES for 6-methyl-4-oxo-3H-furo[2,3-d]pyrimidine-5-carboxylic acid is Cc1oc2nc[nH]c(=O)c2c1C(=O)O.
What is the InChIKey of 6-methyl-4-oxo-3H-furo[2,3-d]pyrimidine-5-carboxylic acid?
The InChIKey is FUUXILGTYMNJST-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6N2O4/c1-3-4(8(12)13)5-6(11)9-2-10-7(5)14-3/h2H,1H3,(H,12,13)(H,9,10,11).
What are the key properties of 6-methyl-4-oxo-3H-furo[2,3-d]pyrimidine-5-carboxylic acid?
6-methyl-4-oxo-3H-furo[2,3-d]pyrimidine-5-carboxylic acid has a molecular weight of 194.15 g/mol, XLogP of 0.52, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-4-oxo-3H-furo[2,3-d]pyrimidine-5-carboxylic acid is sourced from PubChem (CID 4962030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).