5-(furan-2-yl)-1-(2-hydroxy-5-methylphenyl)pyrazole-4-carboxylic acid

C15H12N2O4 — CID 82361488

IUPAC5-(furan-2-yl)-1-(2-hydroxy-5-methylphenyl)pyrazole-4-carboxylic acid
SMILESCc1ccc(O)c(-n2ncc(C(=O)O)c2-c2ccco2)c1
InChIInChI=1S/C15H12N2O4/c1-9-4-5-12(18)11(7-9)17-14(13-3-2-6-21-13)10(8-16-17)15(19)20/h2-8,18H,1H3,(H,19,20)
InChIKeyVKEYFJBYQYEAHG-UHFFFAOYSA-N
MW284.27 g/mol
LogP2.84
Rot. Bonds3

About 5-(furan-2-yl)-1-(2-hydroxy-5-methylphenyl)pyrazole-4-carboxylic acid

5-(furan-2-yl)-1-(2-hydroxy-5-methylphenyl)pyrazole-4-carboxylic acid (PubChem CID 82361488) has the molecular formula C15H12N2O4 and a molecular weight of 284.27 g/mol. Its IUPAC name is 5-(furan-2-yl)-1-(2-hydroxy-5-methylphenyl)pyrazole-4-carboxylic acid.

Molecular Properties

Compound Name5-(furan-2-yl)-1-(2-hydroxy-5-methylphenyl)pyrazole-4-carboxylic acid
PubChem CID82361488
Molecular FormulaC15H12N2O4
Molecular Weight284.27 g/mol
Exact Mass284.08
IUPAC Name5-(furan-2-yl)-1-(2-hydroxy-5-methylphenyl)pyrazole-4-carboxylic acid
SMILESCc1ccc(O)c(-n2ncc(C(=O)O)c2-c2ccco2)c1
InChIInChI=1S/C15H12N2O4/c1-9-4-5-12(18)11(7-9)17-14(13-3-2-6-21-13)10(8-16-17)15(19)20/h2-8,18H,1H3,(H,19,20)
InChIKeyVKEYFJBYQYEAHG-UHFFFAOYSA-N
XLogP2.84
TPSA88.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.27
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 5-(furan-2-yl)-1-(2-hydroxy-5-methylphenyl)pyrazole-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

1-(3,4-dimethylphenyl)-5-(furan-2-yl)pyrazole-4-carboxylic acid
CID 82361473
5-amino-1-(2-hydroxy-4-methylphenyl)pyrazole-4-carboxylic acid
CID 82365343
1-(2-hydroxy-4-methylphenyl)-5-propylpyrazole-4-carboxylic acid
CID 82361192
2-[4-(furan-2-yl)phenyl]-6-methylquinoline-4-carboxylic acid
CID 168527201
2-bromo-5-(furan-2-yl)-4-methylbenzoic acid
CID 168525376
1-methyl-5-(6-methyl-1-benzofuran-2-yl)pyrazole-4-carboxylic acid
CID 115109556
1-(2-hydroxy-5-methylphenyl)-5-propan-2-ylpyrazole-3-carboxylic acid
CID 82361873
3-(furan-2-carbonyl)-4-hydroxy-1-(2-hydroxy-5-methylphenyl)-2-pyridin-4-yl-2H-pyrrol-5-one
CID 108633684
1-(2,5-dimethylphenyl)-5-(2-methylpropyl)pyrazole-4-carboxylic acid
CID 82361395
5-[(2-hydroxy-5-methylphenyl)carbamoyl]-1-methylpyrazole-4-carboxylic acid
CID 25248036
1-(3-methylphenyl)-5-pyrrol-1-ylpyrazole-4-carboxylic acid
CID 46261236
1-(5-chloro-2-hydroxyphenyl)-5-propylpyrazole-4-carboxylic acid
CID 82361205

Frequently Asked Questions

What is the IUPAC name of 5-(furan-2-yl)-1-(2-hydroxy-5-methylphenyl)pyrazole-4-carboxylic acid?
The IUPAC name of 5-(furan-2-yl)-1-(2-hydroxy-5-methylphenyl)pyrazole-4-carboxylic acid (CID 82361488) is 5-(furan-2-yl)-1-(2-hydroxy-5-methylphenyl)pyrazole-4-carboxylic acid.
What is the SMILES notation for 5-(furan-2-yl)-1-(2-hydroxy-5-methylphenyl)pyrazole-4-carboxylic acid?
The canonical SMILES for 5-(furan-2-yl)-1-(2-hydroxy-5-methylphenyl)pyrazole-4-carboxylic acid is Cc1ccc(O)c(-n2ncc(C(=O)O)c2-c2ccco2)c1.
What is the InChIKey of 5-(furan-2-yl)-1-(2-hydroxy-5-methylphenyl)pyrazole-4-carboxylic acid?
The InChIKey is VKEYFJBYQYEAHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O4/c1-9-4-5-12(18)11(7-9)17-14(13-3-2-6-21-13)10(8-16-17)15(19)20/h2-8,18H,1H3,(H,19,20).
What are the key properties of 5-(furan-2-yl)-1-(2-hydroxy-5-methylphenyl)pyrazole-4-carboxylic acid?
5-(furan-2-yl)-1-(2-hydroxy-5-methylphenyl)pyrazole-4-carboxylic acid has a molecular weight of 284.27 g/mol, XLogP of 2.84, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(furan-2-yl)-1-(2-hydroxy-5-methylphenyl)pyrazole-4-carboxylic acid is sourced from PubChem (CID 82361488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).