N-(3,5-dimethyl-1H-pyrazol-4-yl)cyclohexanesulfonamide

C11H19N3O2S — CID 61064428

IUPACN-(3,5-dimethyl-1H-pyrazol-4-yl)cyclohexanesulfonamide
SMILESCc1n[nH]c(C)c1NS(=O)(=O)C1CCCCC1
InChIInChI=1S/C11H19N3O2S/c1-8-11(9(2)13-12-8)14-17(15,16)10-6-4-3-5-7-10/h10,14H,3-7H2,1-2H3,(H,12,13)
InChIKeyCZPJCETYFZJPJN-UHFFFAOYSA-N
MW257.36 g/mol
LogP2.10
Rot. Bonds3

About N-(3,5-dimethyl-1H-pyrazol-4-yl)cyclohexanesulfonamide

N-(3,5-dimethyl-1H-pyrazol-4-yl)cyclohexanesulfonamide (PubChem CID 61064428) has the molecular formula C11H19N3O2S and a molecular weight of 257.36 g/mol. Its IUPAC name is N-(3,5-dimethyl-1H-pyrazol-4-yl)cyclohexanesulfonamide.

Molecular Properties

Compound NameN-(3,5-dimethyl-1H-pyrazol-4-yl)cyclohexanesulfonamide
PubChem CID61064428
Molecular FormulaC11H19N3O2S
Molecular Weight257.36 g/mol
Exact Mass257.12
IUPAC NameN-(3,5-dimethyl-1H-pyrazol-4-yl)cyclohexanesulfonamide
SMILESCc1n[nH]c(C)c1NS(=O)(=O)C1CCCCC1
InChIInChI=1S/C11H19N3O2S/c1-8-11(9(2)13-12-8)14-17(15,16)10-6-4-3-5-7-10/h10,14H,3-7H2,1-2H3,(H,12,13)
InChIKeyCZPJCETYFZJPJN-UHFFFAOYSA-N
XLogP2.10
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.36
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethyl-1H-pyrazol-4-yl)cyclohexanesulfonamide?
The IUPAC name of N-(3,5-dimethyl-1H-pyrazol-4-yl)cyclohexanesulfonamide (CID 61064428) is N-(3,5-dimethyl-1H-pyrazol-4-yl)cyclohexanesulfonamide.
What is the SMILES notation for N-(3,5-dimethyl-1H-pyrazol-4-yl)cyclohexanesulfonamide?
The canonical SMILES for N-(3,5-dimethyl-1H-pyrazol-4-yl)cyclohexanesulfonamide is Cc1n[nH]c(C)c1NS(=O)(=O)C1CCCCC1.
What is the InChIKey of N-(3,5-dimethyl-1H-pyrazol-4-yl)cyclohexanesulfonamide?
The InChIKey is CZPJCETYFZJPJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O2S/c1-8-11(9(2)13-12-8)14-17(15,16)10-6-4-3-5-7-10/h10,14H,3-7H2,1-2H3,(H,12,13).
What are the key properties of N-(3,5-dimethyl-1H-pyrazol-4-yl)cyclohexanesulfonamide?
N-(3,5-dimethyl-1H-pyrazol-4-yl)cyclohexanesulfonamide has a molecular weight of 257.36 g/mol, XLogP of 2.10, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethyl-1H-pyrazol-4-yl)cyclohexanesulfonamide is sourced from PubChem (CID 61064428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).