N,1,3,5-tetramethyl-N-piperidin-4-ylpyrazole-4-sulfonamide;hydrochloride

C12H23ClN4O2S — CID 119966073

IUPACN,1,3,5-tetramethyl-N-piperidin-4-ylpyrazole-4-sulfonamide;hydrochloride
SMILESCc1nn(C)c(C)c1S(=O)(=O)N(C)C1CCNCC1.Cl
InChIInChI=1S/C12H22N4O2S.ClH/c1-9-12(10(2)15(3)14-9)19(17,18)16(4)11-5-7-13-8-6-11;/h11,13H,5-8H2,1-4H3;1H
InChIKeyJWUGDUIOEZZTBP-UHFFFAOYSA-N
MW322.86 g/mol
LogP0.83
Rot. Bonds3

About N,1,3,5-tetramethyl-N-piperidin-4-ylpyrazole-4-sulfonamide;hydrochloride

N,1,3,5-tetramethyl-N-piperidin-4-ylpyrazole-4-sulfonamide;hydrochloride (PubChem CID 119966073) has the molecular formula C12H23ClN4O2S and a molecular weight of 322.86 g/mol. Its IUPAC name is N,1,3,5-tetramethyl-N-piperidin-4-ylpyrazole-4-sulfonamide;hydrochloride.

Molecular Properties

Compound NameN,1,3,5-tetramethyl-N-piperidin-4-ylpyrazole-4-sulfonamide;hydrochloride
PubChem CID119966073
Molecular FormulaC12H23ClN4O2S
Molecular Weight322.86 g/mol
Exact Mass322.12
IUPAC NameN,1,3,5-tetramethyl-N-piperidin-4-ylpyrazole-4-sulfonamide;hydrochloride
SMILESCc1nn(C)c(C)c1S(=O)(=O)N(C)C1CCNCC1.Cl
InChIInChI=1S/C12H22N4O2S.ClH/c1-9-12(10(2)15(3)14-9)19(17,18)16(4)11-5-7-13-8-6-11;/h11,13H,5-8H2,1-4H3;1H
InChIKeyJWUGDUIOEZZTBP-UHFFFAOYSA-N
XLogP0.83
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.86
LogP ≤ 50.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N,3,5-trimethyl-1-(2-methylpropyl)-N-pyrrolidin-3-ylpyrazole-4-sulfonamide
CID 120709837
5-bromo-N,3-dimethyl-N-piperidin-4-yltriazole-4-sulfonamide
CID 106466979
N-(azepan-4-yl)-N,2,4,6-tetramethylbenzenesulfonamide
CID 107173016
1,3,5-trimethyl-N-[(3S)-pyrrolidin-3-yl]pyrazole-4-sulfonamide
CID 79684858
N,1,3,5-tetramethyl-N-(piperidin-2-ylmethyl)pyrazole-4-sulfonamide
CID 106630407
N-piperidin-4-yl-N-propyl-2-[(1,3,5-trimethylpyrazol-4-yl)sulfonylamino]propanamide;hydrochloride
CID 119824243
N,N-diethyl-1,3,5-trimethylpyrazole-4-sulfonamide
CID 19682136
N-(azepan-4-yl)-2,6-difluoro-N-methylbenzenesulfonamide
CID 107173137
N-(2-cyanoethyl)-N-cyclopropyl-1,3,5-trimethylpyrazole-4-sulfonamide
CID 61384412
N-(azepan-4-yl)-N,4-dimethylbenzenesulfonamide
CID 107173095
3,5-dimethyl-1-(2-methylpropyl)-N-piperidin-4-yl-N-propylpyrazole-4-sulfonamide;hydrochloride
CID 120712615
N-[1-(5-fluoro-6-phenylpyrimidin-4-yl)azetidin-3-yl]-N,1,3,5-tetramethylpyrazole-4-sulfonamide
CID 139023647

Frequently Asked Questions

What is the IUPAC name of N,1,3,5-tetramethyl-N-piperidin-4-ylpyrazole-4-sulfonamide;hydrochloride?
The IUPAC name of N,1,3,5-tetramethyl-N-piperidin-4-ylpyrazole-4-sulfonamide;hydrochloride (CID 119966073) is N,1,3,5-tetramethyl-N-piperidin-4-ylpyrazole-4-sulfonamide;hydrochloride.
What is the SMILES notation for N,1,3,5-tetramethyl-N-piperidin-4-ylpyrazole-4-sulfonamide;hydrochloride?
The canonical SMILES for N,1,3,5-tetramethyl-N-piperidin-4-ylpyrazole-4-sulfonamide;hydrochloride is Cc1nn(C)c(C)c1S(=O)(=O)N(C)C1CCNCC1.Cl.
What is the InChIKey of N,1,3,5-tetramethyl-N-piperidin-4-ylpyrazole-4-sulfonamide;hydrochloride?
The InChIKey is JWUGDUIOEZZTBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4O2S.ClH/c1-9-12(10(2)15(3)14-9)19(17,18)16(4)11-5-7-13-8-6-11;/h11,13H,5-8H2,1-4H3;1H.
What are the key properties of N,1,3,5-tetramethyl-N-piperidin-4-ylpyrazole-4-sulfonamide;hydrochloride?
N,1,3,5-tetramethyl-N-piperidin-4-ylpyrazole-4-sulfonamide;hydrochloride has a molecular weight of 322.86 g/mol, XLogP of 0.83, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,1,3,5-tetramethyl-N-piperidin-4-ylpyrazole-4-sulfonamide;hydrochloride is sourced from PubChem (CID 119966073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).