N,N-dimethyl-7-(2-piperidin-1-ylethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-sulfonamide

C15H27N5O2S — CID 131656757

IUPACN,N-dimethyl-7-(2-piperidin-1-ylethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-sulfonamide
SMILESCN(C)S(=O)(=O)N1Cc2ccnn2C(CCN2CCCCC2)C1
InChIInChI=1S/C15H27N5O2S/c1-17(2)23(21,22)19-12-14-6-8-16-20(14)15(13-19)7-11-18-9-4-3-5-10-18/h6,8,15H,3-5,7,9-13H2,1-2H3
InChIKeyUFBQVGLGZSVBMU-UHFFFAOYSA-N
MW341.48 g/mol
LogP0.92
Rot. Bonds5

About N,N-dimethyl-7-(2-piperidin-1-ylethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-sulfonamide

N,N-dimethyl-7-(2-piperidin-1-ylethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-sulfonamide (PubChem CID 131656757) has the molecular formula C15H27N5O2S and a molecular weight of 341.48 g/mol. Its IUPAC name is N,N-dimethyl-7-(2-piperidin-1-ylethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-sulfonamide.

Molecular Properties

Compound NameN,N-dimethyl-7-(2-piperidin-1-ylethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-sulfonamide
PubChem CID131656757
Molecular FormulaC15H27N5O2S
Molecular Weight341.48 g/mol
Exact Mass341.19
IUPAC NameN,N-dimethyl-7-(2-piperidin-1-ylethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-sulfonamide
SMILESCN(C)S(=O)(=O)N1Cc2ccnn2C(CCN2CCCCC2)C1
InChIInChI=1S/C15H27N5O2S/c1-17(2)23(21,22)19-12-14-6-8-16-20(14)15(13-19)7-11-18-9-4-3-5-10-18/h6,8,15H,3-5,7,9-13H2,1-2H3
InChIKeyUFBQVGLGZSVBMU-UHFFFAOYSA-N
XLogP0.92
TPSA61.68 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.48
LogP ≤ 50.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-7-(2-piperidin-1-ylethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-sulfonamide?
The IUPAC name of N,N-dimethyl-7-(2-piperidin-1-ylethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-sulfonamide (CID 131656757) is N,N-dimethyl-7-(2-piperidin-1-ylethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-sulfonamide.
What is the SMILES notation for N,N-dimethyl-7-(2-piperidin-1-ylethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-sulfonamide?
The canonical SMILES for N,N-dimethyl-7-(2-piperidin-1-ylethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-sulfonamide is CN(C)S(=O)(=O)N1Cc2ccnn2C(CCN2CCCCC2)C1.
What is the InChIKey of N,N-dimethyl-7-(2-piperidin-1-ylethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-sulfonamide?
The InChIKey is UFBQVGLGZSVBMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N5O2S/c1-17(2)23(21,22)19-12-14-6-8-16-20(14)15(13-19)7-11-18-9-4-3-5-10-18/h6,8,15H,3-5,7,9-13H2,1-2H3.
What are the key properties of N,N-dimethyl-7-(2-piperidin-1-ylethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-sulfonamide?
N,N-dimethyl-7-(2-piperidin-1-ylethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-sulfonamide has a molecular weight of 341.48 g/mol, XLogP of 0.92, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-7-(2-piperidin-1-ylethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-sulfonamide is sourced from PubChem (CID 131656757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).