N-cyclohexyl-3,5-dimethyl-1H-pyrazole-4-sulfonamide;hydrochloride

C11H20ClN3O2S — CID 126460304

IUPACN-cyclohexyl-3,5-dimethyl-1H-pyrazole-4-sulfonamide;hydrochloride
SMILESCc1n[nH]c(C)c1S(=O)(=O)NC1CCCCC1.Cl
InChIInChI=1S/C11H19N3O2S.ClH/c1-8-11(9(2)13-12-8)17(15,16)14-10-6-4-3-5-7-10;/h10,14H,3-7H2,1-2H3,(H,12,13);1H
InChIKeyJZAASCKWDREUJG-UHFFFAOYSA-N
MW293.82 g/mol
LogP2.06
Rot. Bonds3

About N-cyclohexyl-3,5-dimethyl-1H-pyrazole-4-sulfonamide;hydrochloride

N-cyclohexyl-3,5-dimethyl-1H-pyrazole-4-sulfonamide;hydrochloride (PubChem CID 126460304) has the molecular formula C11H20ClN3O2S and a molecular weight of 293.82 g/mol. Its IUPAC name is N-cyclohexyl-3,5-dimethyl-1H-pyrazole-4-sulfonamide;hydrochloride.

Molecular Properties

Compound NameN-cyclohexyl-3,5-dimethyl-1H-pyrazole-4-sulfonamide;hydrochloride
PubChem CID126460304
Molecular FormulaC11H20ClN3O2S
Molecular Weight293.82 g/mol
Exact Mass293.10
IUPAC NameN-cyclohexyl-3,5-dimethyl-1H-pyrazole-4-sulfonamide;hydrochloride
SMILESCc1n[nH]c(C)c1S(=O)(=O)NC1CCCCC1.Cl
InChIInChI=1S/C11H19N3O2S.ClH/c1-8-11(9(2)13-12-8)17(15,16)14-10-6-4-3-5-7-10;/h10,14H,3-7H2,1-2H3,(H,12,13);1H
InChIKeyJZAASCKWDREUJG-UHFFFAOYSA-N
XLogP2.06
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.82
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-3,5-dimethyl-1H-pyrazole-4-sulfonamide;hydrochloride?
The IUPAC name of N-cyclohexyl-3,5-dimethyl-1H-pyrazole-4-sulfonamide;hydrochloride (CID 126460304) is N-cyclohexyl-3,5-dimethyl-1H-pyrazole-4-sulfonamide;hydrochloride.
What is the SMILES notation for N-cyclohexyl-3,5-dimethyl-1H-pyrazole-4-sulfonamide;hydrochloride?
The canonical SMILES for N-cyclohexyl-3,5-dimethyl-1H-pyrazole-4-sulfonamide;hydrochloride is Cc1n[nH]c(C)c1S(=O)(=O)NC1CCCCC1.Cl.
What is the InChIKey of N-cyclohexyl-3,5-dimethyl-1H-pyrazole-4-sulfonamide;hydrochloride?
The InChIKey is JZAASCKWDREUJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O2S.ClH/c1-8-11(9(2)13-12-8)17(15,16)14-10-6-4-3-5-7-10;/h10,14H,3-7H2,1-2H3,(H,12,13);1H.
What are the key properties of N-cyclohexyl-3,5-dimethyl-1H-pyrazole-4-sulfonamide;hydrochloride?
N-cyclohexyl-3,5-dimethyl-1H-pyrazole-4-sulfonamide;hydrochloride has a molecular weight of 293.82 g/mol, XLogP of 2.06, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-3,5-dimethyl-1H-pyrazole-4-sulfonamide;hydrochloride is sourced from PubChem (CID 126460304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).