2-(4-methoxy-2,6-dimethylphenyl)pyrazolo[1,5-a]pyrimidine-6-carboxylic acid

C16H15N3O3 — CID 82371047

IUPAC2-(4-methoxy-2,6-dimethylphenyl)pyrazolo[1,5-a]pyrimidine-6-carboxylic acid
SMILESCOc1cc(C)c(-c2cc3ncc(C(=O)O)cn3n2)c(C)c1
InChIInChI=1S/C16H15N3O3/c1-9-4-12(22-3)5-10(2)15(9)13-6-14-17-7-11(16(20)21)8-19(14)18-13/h4-8H,1-3H3,(H,20,21)
InChIKeyIULAMWDHFZNUOD-UHFFFAOYSA-N
MW297.31 g/mol
LogP2.72
Rot. Bonds3

About 2-(4-methoxy-2,6-dimethylphenyl)pyrazolo[1,5-a]pyrimidine-6-carboxylic acid

2-(4-methoxy-2,6-dimethylphenyl)pyrazolo[1,5-a]pyrimidine-6-carboxylic acid (PubChem CID 82371047) has the molecular formula C16H15N3O3 and a molecular weight of 297.31 g/mol. Its IUPAC name is 2-(4-methoxy-2,6-dimethylphenyl)pyrazolo[1,5-a]pyrimidine-6-carboxylic acid.

Molecular Properties

Compound Name2-(4-methoxy-2,6-dimethylphenyl)pyrazolo[1,5-a]pyrimidine-6-carboxylic acid
PubChem CID82371047
Molecular FormulaC16H15N3O3
Molecular Weight297.31 g/mol
Exact Mass297.11
IUPAC Name2-(4-methoxy-2,6-dimethylphenyl)pyrazolo[1,5-a]pyrimidine-6-carboxylic acid
SMILESCOc1cc(C)c(-c2cc3ncc(C(=O)O)cn3n2)c(C)c1
InChIInChI=1S/C16H15N3O3/c1-9-4-12(22-3)5-10(2)15(9)13-6-14-17-7-11(16(20)21)8-19(14)18-13/h4-8H,1-3H3,(H,20,21)
InChIKeyIULAMWDHFZNUOD-UHFFFAOYSA-N
XLogP2.72
TPSA76.72 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.31
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-(4-methoxy-2,6-dimethylphenyl)pyrazolo[1,5-a]pyrimidine-6-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-(3-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-6-carboxylic acid
CID 82371025
2-(2,5-dimethoxyphenyl)pyrazolo[1,5-a]pyrimidine-6-carboxylic acid
CID 82371033
2-bromopyrazolo[1,5-a]pyrimidine-6-carboxylic acid
CID 84703019
4-methoxy-3-methylpyrazolo[1,5-a]pyridine-6-carboxylic acid
CID 166171852
3-(4-methoxy-2,6-dimethylphenyl)-1,2-oxazole-5-carboxylic acid
CID 82371528
2-benzylpyrazolo[1,5-a]pyrimidine-6-carboxylic acid
CID 156508030
5-(4-methoxy-2,6-dimethylphenyl)-1,3-oxazole-2-carboxylic acid
CID 82049390
6-(3,5-dimethoxyphenoxy)pyridine-3-carboxylic acid
CID 43589848
3-amino-2-methylpyrazolo[1,5-a]pyrimidine-6-carboxylic acid
CID 83818121
(2-hydroxyphenyl)-[2-(4-methylphenyl)pyrazolo[1,5-a]pyrimidin-6-yl]methanone
CID 11023968
2-[4-(4-methoxyphenyl)phenyl]imidazo[1,2-a]pyrimidine-6-carboxylic acid
CID 83779274
6-(4-methoxy-2-methylanilino)pyridine-3-carboxylic acid
CID 55130145

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxy-2,6-dimethylphenyl)pyrazolo[1,5-a]pyrimidine-6-carboxylic acid?
The IUPAC name of 2-(4-methoxy-2,6-dimethylphenyl)pyrazolo[1,5-a]pyrimidine-6-carboxylic acid (CID 82371047) is 2-(4-methoxy-2,6-dimethylphenyl)pyrazolo[1,5-a]pyrimidine-6-carboxylic acid.
What is the SMILES notation for 2-(4-methoxy-2,6-dimethylphenyl)pyrazolo[1,5-a]pyrimidine-6-carboxylic acid?
The canonical SMILES for 2-(4-methoxy-2,6-dimethylphenyl)pyrazolo[1,5-a]pyrimidine-6-carboxylic acid is COc1cc(C)c(-c2cc3ncc(C(=O)O)cn3n2)c(C)c1.
What is the InChIKey of 2-(4-methoxy-2,6-dimethylphenyl)pyrazolo[1,5-a]pyrimidine-6-carboxylic acid?
The InChIKey is IULAMWDHFZNUOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O3/c1-9-4-12(22-3)5-10(2)15(9)13-6-14-17-7-11(16(20)21)8-19(14)18-13/h4-8H,1-3H3,(H,20,21).
What are the key properties of 2-(4-methoxy-2,6-dimethylphenyl)pyrazolo[1,5-a]pyrimidine-6-carboxylic acid?
2-(4-methoxy-2,6-dimethylphenyl)pyrazolo[1,5-a]pyrimidine-6-carboxylic acid has a molecular weight of 297.31 g/mol, XLogP of 2.72, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxy-2,6-dimethylphenyl)pyrazolo[1,5-a]pyrimidine-6-carboxylic acid is sourced from PubChem (CID 82371047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).