N,N-dimethyl-4-(pyrazol-1-ylmethyl)piperidine-1-sulfonamide

C11H20N4O2S — CID 73167590

IUPACN,N-dimethyl-4-(pyrazol-1-ylmethyl)piperidine-1-sulfonamide
SMILESCN(C)S(=O)(=O)N1CCC(Cn2cccn2)CC1
InChIInChI=1S/C11H20N4O2S/c1-13(2)18(16,17)15-8-4-11(5-9-15)10-14-7-3-6-12-14/h3,6-7,11H,4-5,8-10H2,1-2H3
InChIKeyZGNUMTZOEYVHSJ-UHFFFAOYSA-N
MW272.37 g/mol
LogP0.40
Rot. Bonds4

About N,N-dimethyl-4-(pyrazol-1-ylmethyl)piperidine-1-sulfonamide

N,N-dimethyl-4-(pyrazol-1-ylmethyl)piperidine-1-sulfonamide (PubChem CID 73167590) has the molecular formula C11H20N4O2S and a molecular weight of 272.37 g/mol. Its IUPAC name is N,N-dimethyl-4-(pyrazol-1-ylmethyl)piperidine-1-sulfonamide.

Molecular Properties

Compound NameN,N-dimethyl-4-(pyrazol-1-ylmethyl)piperidine-1-sulfonamide
PubChem CID73167590
Molecular FormulaC11H20N4O2S
Molecular Weight272.37 g/mol
Exact Mass272.13
IUPAC NameN,N-dimethyl-4-(pyrazol-1-ylmethyl)piperidine-1-sulfonamide
SMILESCN(C)S(=O)(=O)N1CCC(Cn2cccn2)CC1
InChIInChI=1S/C11H20N4O2S/c1-13(2)18(16,17)15-8-4-11(5-9-15)10-14-7-3-6-12-14/h3,6-7,11H,4-5,8-10H2,1-2H3
InChIKeyZGNUMTZOEYVHSJ-UHFFFAOYSA-N
XLogP0.40
TPSA58.44 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.37
LogP ≤ 50.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-(1H-pyrazol-1-ylmethyl)piperidine
CID 28063741
4-(2-(1H-Pyrazol-1-yl)ethyl)piperidine
CID 28064142
4-((1H-Pyrazol-1-YL)methyl)piperidine hydrochloride
CID 66617726
N-methyl-N-[(1-methylpyrazol-4-yl)methyl]piperidine-1-sulfonamide
CID 45806340
4-(1H-pyrazol-1-ylmethyl)piperidine dihydrochloride
CID 54759129
4-((1H-pyrazol-1-yl)methyl)-1-(cyclopropylsulfonyl)piperidine
CID 71781205
N-[(1-methylpyrazol-4-yl)methyl]-N-[(1-methylsulfonylpiperidin-3-yl)methyl]propan-1-amine
CID 75425329
1-(4-((1H-pyrazol-1-yl)methyl)piperidin-1-yl)ethanone
CID 52906688
N-(3-pyrazol-1-ylpropyl)piperidine-1-sulfonamide
CID 37622508
(3S)-3-methyl-N-(3-pyrazol-1-ylpropyl)piperidine-1-sulfonamide
CID 94021637
N,4-dimethyl-N-(1-methylpyrazol-3-yl)piperidine-1-sulfonamide
CID 126798316
1-methyl-4-[[(3S)-1-(3-pyrazol-1-ylpropyl)piperidin-3-yl]methyl]piperazine
CID 171359820

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-(pyrazol-1-ylmethyl)piperidine-1-sulfonamide?
The IUPAC name of N,N-dimethyl-4-(pyrazol-1-ylmethyl)piperidine-1-sulfonamide (CID 73167590) is N,N-dimethyl-4-(pyrazol-1-ylmethyl)piperidine-1-sulfonamide.
What is the SMILES notation for N,N-dimethyl-4-(pyrazol-1-ylmethyl)piperidine-1-sulfonamide?
The canonical SMILES for N,N-dimethyl-4-(pyrazol-1-ylmethyl)piperidine-1-sulfonamide is CN(C)S(=O)(=O)N1CCC(Cn2cccn2)CC1.
What is the InChIKey of N,N-dimethyl-4-(pyrazol-1-ylmethyl)piperidine-1-sulfonamide?
The InChIKey is ZGNUMTZOEYVHSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O2S/c1-13(2)18(16,17)15-8-4-11(5-9-15)10-14-7-3-6-12-14/h3,6-7,11H,4-5,8-10H2,1-2H3.
What are the key properties of N,N-dimethyl-4-(pyrazol-1-ylmethyl)piperidine-1-sulfonamide?
N,N-dimethyl-4-(pyrazol-1-ylmethyl)piperidine-1-sulfonamide has a molecular weight of 272.37 g/mol, XLogP of 0.40, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-(pyrazol-1-ylmethyl)piperidine-1-sulfonamide is sourced from PubChem (CID 73167590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).