1-cyclopentylsulfonyl-4-ethylpyrazole

C10H16N2O2S — CID 130194961

IUPAC1-cyclopentylsulfonyl-4-ethylpyrazole
SMILESCCc1cnn(S(=O)(=O)C2CCCC2)c1
InChIInChI=1S/C10H16N2O2S/c1-2-9-7-11-12(8-9)15(13,14)10-5-3-4-6-10/h7-8,10H,2-6H2,1H3
InChIKeyQLABFUYKXMFGBN-UHFFFAOYSA-N
MW228.32 g/mol
LogP1.57
Rot. Bonds3

About 1-cyclopentylsulfonyl-4-ethylpyrazole

1-cyclopentylsulfonyl-4-ethylpyrazole (PubChem CID 130194961) has the molecular formula C10H16N2O2S and a molecular weight of 228.32 g/mol. Its IUPAC name is 1-cyclopentylsulfonyl-4-ethylpyrazole.

Molecular Properties

Compound Name1-cyclopentylsulfonyl-4-ethylpyrazole
PubChem CID130194961
Molecular FormulaC10H16N2O2S
Molecular Weight228.32 g/mol
Exact Mass228.09
IUPAC Name1-cyclopentylsulfonyl-4-ethylpyrazole
SMILESCCc1cnn(S(=O)(=O)C2CCCC2)c1
InChIInChI=1S/C10H16N2O2S/c1-2-9-7-11-12(8-9)15(13,14)10-5-3-4-6-10/h7-8,10H,2-6H2,1H3
InChIKeyQLABFUYKXMFGBN-UHFFFAOYSA-N
XLogP1.57
TPSA51.96 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.32
LogP ≤ 51.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-cyclopentylsulfonyl-4-ethylpyrazole 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 1-cyclopentylsulfonyl-4-ethylpyrazole?
The IUPAC name of 1-cyclopentylsulfonyl-4-ethylpyrazole (CID 130194961) is 1-cyclopentylsulfonyl-4-ethylpyrazole.
What is the SMILES notation for 1-cyclopentylsulfonyl-4-ethylpyrazole?
The canonical SMILES for 1-cyclopentylsulfonyl-4-ethylpyrazole is CCc1cnn(S(=O)(=O)C2CCCC2)c1.
What is the InChIKey of 1-cyclopentylsulfonyl-4-ethylpyrazole?
The InChIKey is QLABFUYKXMFGBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2S/c1-2-9-7-11-12(8-9)15(13,14)10-5-3-4-6-10/h7-8,10H,2-6H2,1H3.
What are the key properties of 1-cyclopentylsulfonyl-4-ethylpyrazole?
1-cyclopentylsulfonyl-4-ethylpyrazole has a molecular weight of 228.32 g/mol, XLogP of 1.57, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentylsulfonyl-4-ethylpyrazole is sourced from PubChem (CID 130194961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).