3-piperidin-1-ylsulfonyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine;hydrochloride

C11H19ClN4O2S — CID 167313705

IUPAC3-piperidin-1-ylsulfonyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine;hydrochloride
SMILESCl.O=S(=O)(c1cnn2c1CNCC2)N1CCCCC1
InChIInChI=1S/C11H18N4O2S.ClH/c16-18(17,14-5-2-1-3-6-14)11-9-13-15-7-4-12-8-10(11)15;/h9,12H,1-8H2;1H
InChIKeyMXEXLQIHGJTVRZ-UHFFFAOYSA-N
MW306.82 g/mol
LogP0.58
Rot. Bonds2

About 3-piperidin-1-ylsulfonyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine;hydrochloride

3-piperidin-1-ylsulfonyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine;hydrochloride (PubChem CID 167313705) has the molecular formula C11H19ClN4O2S and a molecular weight of 306.82 g/mol. Its IUPAC name is 3-piperidin-1-ylsulfonyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine;hydrochloride.

Molecular Properties

Compound Name3-piperidin-1-ylsulfonyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine;hydrochloride
PubChem CID167313705
Molecular FormulaC11H19ClN4O2S
Molecular Weight306.82 g/mol
Exact Mass306.09
IUPAC Name3-piperidin-1-ylsulfonyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine;hydrochloride
SMILESCl.O=S(=O)(c1cnn2c1CNCC2)N1CCCCC1
InChIInChI=1S/C11H18N4O2S.ClH/c16-18(17,14-5-2-1-3-6-14)11-9-13-15-7-4-12-8-10(11)15;/h9,12H,1-8H2;1H
InChIKeyMXEXLQIHGJTVRZ-UHFFFAOYSA-N
XLogP0.58
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.82
LogP ≤ 50.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 3-piperidin-1-ylsulfonyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-3-sulfonyl fluoride
CID 163333345
3-[[3-(2-methylphenyl)-2,5-dihydropyrrol-1-yl]sulfonyl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine
CID 167807564
1-[(5-methyl-1H-pyrazol-4-yl)sulfonyl]azocane
CID 54929965
N-[cyclobutyl(pyridin-4-yl)methyl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-3-sulfonamide
CID 167775053
N,N-dimethyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-3-carboxamide
CID 130559980
3-propan-2-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine
CID 144863048
1-(2,3-dichlorophenyl)sulfonyl-1,4-diazepane;hydrochloride
CID 119963200
3-(5-fluoropyrimidin-2-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine
CID 121483953
3-fluoro-5-[1-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-ylsulfonyl)piperidin-3-yl]phenol
CID 167984678
5,5-dimethyl-3-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-3-yl)-1,3-oxazolidin-2-one
CID 155434684
1-(1H-imidazol-5-ylsulfonyl)piperazine;hydrochloride
CID 71778822
5-piperidin-1-ylsulfonyl-1H-pyrimidin-2-one
CID 123394994

Frequently Asked Questions

What is the IUPAC name of 3-piperidin-1-ylsulfonyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine;hydrochloride?
The IUPAC name of 3-piperidin-1-ylsulfonyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine;hydrochloride (CID 167313705) is 3-piperidin-1-ylsulfonyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine;hydrochloride.
What is the SMILES notation for 3-piperidin-1-ylsulfonyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine;hydrochloride?
The canonical SMILES for 3-piperidin-1-ylsulfonyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine;hydrochloride is Cl.O=S(=O)(c1cnn2c1CNCC2)N1CCCCC1.
What is the InChIKey of 3-piperidin-1-ylsulfonyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine;hydrochloride?
The InChIKey is MXEXLQIHGJTVRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O2S.ClH/c16-18(17,14-5-2-1-3-6-14)11-9-13-15-7-4-12-8-10(11)15;/h9,12H,1-8H2;1H.
What are the key properties of 3-piperidin-1-ylsulfonyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine;hydrochloride?
3-piperidin-1-ylsulfonyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine;hydrochloride has a molecular weight of 306.82 g/mol, XLogP of 0.58, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-piperidin-1-ylsulfonyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine;hydrochloride is sourced from PubChem (CID 167313705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).