6-[3-(dimethylcarbamoyl)pyrazol-1-yl]pyridazine-3-carboxylic acid

C11H11N5O3 — CID 64781715

IUPAC6-[3-(dimethylcarbamoyl)pyrazol-1-yl]pyridazine-3-carboxylic acid
SMILESCN(C)C(=O)c1ccn(-c2ccc(C(=O)O)nn2)n1
InChIInChI=1S/C11H11N5O3/c1-15(2)10(17)7-5-6-16(14-7)9-4-3-8(11(18)19)12-13-9/h3-6H,1-2H3,(H,18,19)
InChIKeySAFKAZXIMRETTO-UHFFFAOYSA-N
MW261.24 g/mol
LogP0.06
Rot. Bonds3

About 6-[3-(dimethylcarbamoyl)pyrazol-1-yl]pyridazine-3-carboxylic acid

6-[3-(dimethylcarbamoyl)pyrazol-1-yl]pyridazine-3-carboxylic acid (PubChem CID 64781715) has the molecular formula C11H11N5O3 and a molecular weight of 261.24 g/mol. Its IUPAC name is 6-[3-(dimethylcarbamoyl)pyrazol-1-yl]pyridazine-3-carboxylic acid.

Molecular Properties

Compound Name6-[3-(dimethylcarbamoyl)pyrazol-1-yl]pyridazine-3-carboxylic acid
PubChem CID64781715
Molecular FormulaC11H11N5O3
Molecular Weight261.24 g/mol
Exact Mass261.09
IUPAC Name6-[3-(dimethylcarbamoyl)pyrazol-1-yl]pyridazine-3-carboxylic acid
SMILESCN(C)C(=O)c1ccn(-c2ccc(C(=O)O)nn2)n1
InChIInChI=1S/C11H11N5O3/c1-15(2)10(17)7-5-6-16(14-7)9-4-3-8(11(18)19)12-13-9/h3-6H,1-2H3,(H,18,19)
InChIKeySAFKAZXIMRETTO-UHFFFAOYSA-N
XLogP0.06
TPSA101.21 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.24
LogP ≤ 50.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 6-[3-(dimethylcarbamoyl)pyrazol-1-yl]pyridazine-3-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-[3-(dimethylcarbamoyl)pyrazol-1-yl]pyridazine-3-carboxylic acid?
The IUPAC name of 6-[3-(dimethylcarbamoyl)pyrazol-1-yl]pyridazine-3-carboxylic acid (CID 64781715) is 6-[3-(dimethylcarbamoyl)pyrazol-1-yl]pyridazine-3-carboxylic acid.
What is the SMILES notation for 6-[3-(dimethylcarbamoyl)pyrazol-1-yl]pyridazine-3-carboxylic acid?
The canonical SMILES for 6-[3-(dimethylcarbamoyl)pyrazol-1-yl]pyridazine-3-carboxylic acid is CN(C)C(=O)c1ccn(-c2ccc(C(=O)O)nn2)n1.
What is the InChIKey of 6-[3-(dimethylcarbamoyl)pyrazol-1-yl]pyridazine-3-carboxylic acid?
The InChIKey is SAFKAZXIMRETTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N5O3/c1-15(2)10(17)7-5-6-16(14-7)9-4-3-8(11(18)19)12-13-9/h3-6H,1-2H3,(H,18,19).
What are the key properties of 6-[3-(dimethylcarbamoyl)pyrazol-1-yl]pyridazine-3-carboxylic acid?
6-[3-(dimethylcarbamoyl)pyrazol-1-yl]pyridazine-3-carboxylic acid has a molecular weight of 261.24 g/mol, XLogP of 0.06, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[3-(dimethylcarbamoyl)pyrazol-1-yl]pyridazine-3-carboxylic acid is sourced from PubChem (CID 64781715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).