N,4-dimethyl-N-(1-methylpyrazol-3-yl)piperidine-1-sulfonamide

C11H20N4O2S — CID 126798316

IUPACN,4-dimethyl-N-(1-methylpyrazol-3-yl)piperidine-1-sulfonamide
SMILESCC1CCN(S(=O)(=O)N(C)c2ccn(C)n2)CC1
InChIInChI=1S/C11H20N4O2S/c1-10-4-8-15(9-5-10)18(16,17)14(3)11-6-7-13(2)12-11/h6-7,10H,4-5,8-9H2,1-3H3
InChIKeyIPUVAYPOFBSRSY-UHFFFAOYSA-N
MW272.37 g/mol
LogP0.83
Rot. Bonds3

About N,4-dimethyl-N-(1-methylpyrazol-3-yl)piperidine-1-sulfonamide

N,4-dimethyl-N-(1-methylpyrazol-3-yl)piperidine-1-sulfonamide (PubChem CID 126798316) has the molecular formula C11H20N4O2S and a molecular weight of 272.37 g/mol. Its IUPAC name is N,4-dimethyl-N-(1-methylpyrazol-3-yl)piperidine-1-sulfonamide.

Molecular Properties

Compound NameN,4-dimethyl-N-(1-methylpyrazol-3-yl)piperidine-1-sulfonamide
PubChem CID126798316
Molecular FormulaC11H20N4O2S
Molecular Weight272.37 g/mol
Exact Mass272.13
IUPAC NameN,4-dimethyl-N-(1-methylpyrazol-3-yl)piperidine-1-sulfonamide
SMILESCC1CCN(S(=O)(=O)N(C)c2ccn(C)n2)CC1
InChIInChI=1S/C11H20N4O2S/c1-10-4-8-15(9-5-10)18(16,17)14(3)11-6-7-13(2)12-11/h6-7,10H,4-5,8-9H2,1-3H3
InChIKeyIPUVAYPOFBSRSY-UHFFFAOYSA-N
XLogP0.83
TPSA58.44 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.37
LogP ≤ 50.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,4-dimethyl-N-(1-methylpyrazol-3-yl)piperidine-1-sulfonamide?
The IUPAC name of N,4-dimethyl-N-(1-methylpyrazol-3-yl)piperidine-1-sulfonamide (CID 126798316) is N,4-dimethyl-N-(1-methylpyrazol-3-yl)piperidine-1-sulfonamide.
What is the SMILES notation for N,4-dimethyl-N-(1-methylpyrazol-3-yl)piperidine-1-sulfonamide?
The canonical SMILES for N,4-dimethyl-N-(1-methylpyrazol-3-yl)piperidine-1-sulfonamide is CC1CCN(S(=O)(=O)N(C)c2ccn(C)n2)CC1.
What is the InChIKey of N,4-dimethyl-N-(1-methylpyrazol-3-yl)piperidine-1-sulfonamide?
The InChIKey is IPUVAYPOFBSRSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O2S/c1-10-4-8-15(9-5-10)18(16,17)14(3)11-6-7-13(2)12-11/h6-7,10H,4-5,8-9H2,1-3H3.
What are the key properties of N,4-dimethyl-N-(1-methylpyrazol-3-yl)piperidine-1-sulfonamide?
N,4-dimethyl-N-(1-methylpyrazol-3-yl)piperidine-1-sulfonamide has a molecular weight of 272.37 g/mol, XLogP of 0.83, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-dimethyl-N-(1-methylpyrazol-3-yl)piperidine-1-sulfonamide is sourced from PubChem (CID 126798316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).