6-[2-(2-methylpyrazol-3-yl)ethyl]piperidine-3-sulfonamide

C11H20N4O2S — CID 106777661

IUPAC6-[2-(2-methylpyrazol-3-yl)ethyl]piperidine-3-sulfonamide
SMILESCn1nccc1CCC1CCC(S(N)(=O)=O)CN1
InChIInChI=1S/C11H20N4O2S/c1-15-10(6-7-14-15)4-2-9-3-5-11(8-13-9)18(12,16)17/h6-7,9,11,13H,2-5,8H2,1H3,(H2,12,16,17)
InChIKeyLCFUYZPYPHWJEQ-UHFFFAOYSA-N
MW272.37 g/mol
LogP-0.24
Rot. Bonds4

About 6-[2-(2-methylpyrazol-3-yl)ethyl]piperidine-3-sulfonamide

6-[2-(2-methylpyrazol-3-yl)ethyl]piperidine-3-sulfonamide (PubChem CID 106777661) has the molecular formula C11H20N4O2S and a molecular weight of 272.37 g/mol. Its IUPAC name is 6-[2-(2-methylpyrazol-3-yl)ethyl]piperidine-3-sulfonamide.

Molecular Properties

Compound Name6-[2-(2-methylpyrazol-3-yl)ethyl]piperidine-3-sulfonamide
PubChem CID106777661
Molecular FormulaC11H20N4O2S
Molecular Weight272.37 g/mol
Exact Mass272.13
IUPAC Name6-[2-(2-methylpyrazol-3-yl)ethyl]piperidine-3-sulfonamide
SMILESCn1nccc1CCC1CCC(S(N)(=O)=O)CN1
InChIInChI=1S/C11H20N4O2S/c1-15-10(6-7-14-15)4-2-9-3-5-11(8-13-9)18(12,16)17/h6-7,9,11,13H,2-5,8H2,1H3,(H2,12,16,17)
InChIKeyLCFUYZPYPHWJEQ-UHFFFAOYSA-N
XLogP-0.24
TPSA90.01 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.37
LogP ≤ 5-0.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[2-(2-methylpyrazol-3-yl)ethyl]azepane
CID 103015057
N-[2-(2-methylpyrazol-3-yl)ethyl]-1-piperidin-4-ylmethanesulfonamide
CID 103008088
1-[1-[2-(2-methylpyrazol-3-yl)ethyl]piperidin-4-yl]ethanamine
CID 102999214
N-methyl-2-[2-(2-methylpyrazol-3-yl)ethyl]cyclohexan-1-amine
CID 103004400
N-[(2-methylpyrazol-3-yl)methyl]pyrrolidine-3-sulfonamide
CID 65418761
3-(2-methylpyrazol-3-yl)-1-(2-methylpyrrolidin-3-yl)propan-1-one
CID 103023936
4-[2-(2-methylpyrazol-3-yl)ethyl]thiolan-3-amine
CID 103004598
4-[1-[2-(2-methylpyrazol-3-yl)ethyl]spiro[2.4]heptan-2-yl]benzenesulfonamide
CID 158075983
1-[(1S,6R)-3,9-diazabicyclo[4.2.1]nonan-9-yl]-3-(2-methylpyrazol-3-yl)propan-1-one;hydrochloride
CID 154900676
4-chloro-1-[2-(2-methylpyrazol-3-yl)ethyl]piperidine
CID 103015106
2-butan-2-yl-1-[2-(2-methylpyrazol-3-yl)ethyl]-5-propylpiperazine
CID 103016284
4-methyl-2-[2-(2-methylpyrazol-3-yl)ethyl]cyclohexane-1-carboxylic acid
CID 103019597

Frequently Asked Questions

What is the IUPAC name of 6-[2-(2-methylpyrazol-3-yl)ethyl]piperidine-3-sulfonamide?
The IUPAC name of 6-[2-(2-methylpyrazol-3-yl)ethyl]piperidine-3-sulfonamide (CID 106777661) is 6-[2-(2-methylpyrazol-3-yl)ethyl]piperidine-3-sulfonamide.
What is the SMILES notation for 6-[2-(2-methylpyrazol-3-yl)ethyl]piperidine-3-sulfonamide?
The canonical SMILES for 6-[2-(2-methylpyrazol-3-yl)ethyl]piperidine-3-sulfonamide is Cn1nccc1CCC1CCC(S(N)(=O)=O)CN1.
What is the InChIKey of 6-[2-(2-methylpyrazol-3-yl)ethyl]piperidine-3-sulfonamide?
The InChIKey is LCFUYZPYPHWJEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O2S/c1-15-10(6-7-14-15)4-2-9-3-5-11(8-13-9)18(12,16)17/h6-7,9,11,13H,2-5,8H2,1H3,(H2,12,16,17).
What are the key properties of 6-[2-(2-methylpyrazol-3-yl)ethyl]piperidine-3-sulfonamide?
6-[2-(2-methylpyrazol-3-yl)ethyl]piperidine-3-sulfonamide has a molecular weight of 272.37 g/mol, XLogP of -0.24, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(2-methylpyrazol-3-yl)ethyl]piperidine-3-sulfonamide is sourced from PubChem (CID 106777661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).