3-(cyclohexylsulfonylamino)-1H-pyrazole-5-carboxylic acid

C10H15N3O4S — CID 64526319

IUPAC3-(cyclohexylsulfonylamino)-1H-pyrazole-5-carboxylic acid
SMILESO=C(O)c1cc(NS(=O)(=O)C2CCCCC2)n[nH]1
InChIInChI=1S/C10H15N3O4S/c14-10(15)8-6-9(12-11-8)13-18(16,17)7-4-2-1-3-5-7/h6-7H,1-5H2,(H,14,15)(H2,11,12,13)
InChIKeyYEWIJSCVFRMGHI-UHFFFAOYSA-N
MW273.31 g/mol
LogP1.18
Rot. Bonds4

About 3-(cyclohexylsulfonylamino)-1H-pyrazole-5-carboxylic acid

3-(cyclohexylsulfonylamino)-1H-pyrazole-5-carboxylic acid (PubChem CID 64526319) has the molecular formula C10H15N3O4S and a molecular weight of 273.31 g/mol. Its IUPAC name is 3-(cyclohexylsulfonylamino)-1H-pyrazole-5-carboxylic acid.

Molecular Properties

Compound Name3-(cyclohexylsulfonylamino)-1H-pyrazole-5-carboxylic acid
PubChem CID64526319
Molecular FormulaC10H15N3O4S
Molecular Weight273.31 g/mol
Exact Mass273.08
IUPAC Name3-(cyclohexylsulfonylamino)-1H-pyrazole-5-carboxylic acid
SMILESO=C(O)c1cc(NS(=O)(=O)C2CCCCC2)n[nH]1
InChIInChI=1S/C10H15N3O4S/c14-10(15)8-6-9(12-11-8)13-18(16,17)7-4-2-1-3-5-7/h6-7H,1-5H2,(H,14,15)(H2,11,12,13)
InChIKeyYEWIJSCVFRMGHI-UHFFFAOYSA-N
XLogP1.18
TPSA112.15 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.31
LogP ≤ 51.18
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 3-(cyclohexylsulfonylamino)-1H-pyrazole-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 3-(cyclohexylsulfonylamino)-1H-pyrazole-5-carboxylic acid?
The IUPAC name of 3-(cyclohexylsulfonylamino)-1H-pyrazole-5-carboxylic acid (CID 64526319) is 3-(cyclohexylsulfonylamino)-1H-pyrazole-5-carboxylic acid.
What is the SMILES notation for 3-(cyclohexylsulfonylamino)-1H-pyrazole-5-carboxylic acid?
The canonical SMILES for 3-(cyclohexylsulfonylamino)-1H-pyrazole-5-carboxylic acid is O=C(O)c1cc(NS(=O)(=O)C2CCCCC2)n[nH]1.
What is the InChIKey of 3-(cyclohexylsulfonylamino)-1H-pyrazole-5-carboxylic acid?
The InChIKey is YEWIJSCVFRMGHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O4S/c14-10(15)8-6-9(12-11-8)13-18(16,17)7-4-2-1-3-5-7/h6-7H,1-5H2,(H,14,15)(H2,11,12,13).
What are the key properties of 3-(cyclohexylsulfonylamino)-1H-pyrazole-5-carboxylic acid?
3-(cyclohexylsulfonylamino)-1H-pyrazole-5-carboxylic acid has a molecular weight of 273.31 g/mol, XLogP of 1.18, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclohexylsulfonylamino)-1H-pyrazole-5-carboxylic acid is sourced from PubChem (CID 64526319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).