4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-3-sulfonyl fluoride

C6H8FN3O2S — CID 163333345

IUPAC4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-3-sulfonyl fluoride
SMILESO=S(=O)(F)c1cnn2c1CNCC2
InChIInChI=1S/C6H8FN3O2S/c7-13(11,12)6-4-9-10-2-1-8-3-5(6)10/h4,8H,1-3H2
InChIKeyFVRRBUNBKRYJLQ-UHFFFAOYSA-N
MW205.21 g/mol
LogP-0.36
Rot. Bonds1

About 4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-3-sulfonyl fluoride

4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-3-sulfonyl fluoride (PubChem CID 163333345) has the molecular formula C6H8FN3O2S and a molecular weight of 205.21 g/mol. Its IUPAC name is 4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-3-sulfonyl fluoride.

Molecular Properties

Compound Name4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-3-sulfonyl fluoride
PubChem CID163333345
Molecular FormulaC6H8FN3O2S
Molecular Weight205.21 g/mol
Exact Mass205.03
IUPAC Name4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-3-sulfonyl fluoride
SMILESO=S(=O)(F)c1cnn2c1CNCC2
InChIInChI=1S/C6H8FN3O2S/c7-13(11,12)6-4-9-10-2-1-8-3-5(6)10/h4,8H,1-3H2
InChIKeyFVRRBUNBKRYJLQ-UHFFFAOYSA-N
XLogP-0.36
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.21
LogP ≤ 5-0.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-3-sulfonyl fluoride 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 4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-3-sulfonyl fluoride?
The IUPAC name of 4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-3-sulfonyl fluoride (CID 163333345) is 4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-3-sulfonyl fluoride.
What is the SMILES notation for 4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-3-sulfonyl fluoride?
The canonical SMILES for 4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-3-sulfonyl fluoride is O=S(=O)(F)c1cnn2c1CNCC2.
What is the InChIKey of 4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-3-sulfonyl fluoride?
The InChIKey is FVRRBUNBKRYJLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8FN3O2S/c7-13(11,12)6-4-9-10-2-1-8-3-5(6)10/h4,8H,1-3H2.
What are the key properties of 4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-3-sulfonyl fluoride?
4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-3-sulfonyl fluoride has a molecular weight of 205.21 g/mol, XLogP of -0.36, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-3-sulfonyl fluoride is sourced from PubChem (CID 163333345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).