N-(4-ethylcyclohexyl)-1H-pyrazole-4-sulfonamide

C11H19N3O2S — CID 61354875

IUPACN-(4-ethylcyclohexyl)-1H-pyrazole-4-sulfonamide
SMILESCCC1CCC(NS(=O)(=O)c2cn[nH]c2)CC1
InChIInChI=1S/C11H19N3O2S/c1-2-9-3-5-10(6-4-9)14-17(15,16)11-7-12-13-8-11/h7-10,14H,2-6H2,1H3,(H,12,13)
InChIKeyWWYZKJXGEICCAC-UHFFFAOYSA-N
MW257.36 g/mol
LogP1.66
Rot. Bonds4

About N-(4-ethylcyclohexyl)-1H-pyrazole-4-sulfonamide

N-(4-ethylcyclohexyl)-1H-pyrazole-4-sulfonamide (PubChem CID 61354875) has the molecular formula C11H19N3O2S and a molecular weight of 257.36 g/mol. Its IUPAC name is N-(4-ethylcyclohexyl)-1H-pyrazole-4-sulfonamide.

Molecular Properties

Compound NameN-(4-ethylcyclohexyl)-1H-pyrazole-4-sulfonamide
PubChem CID61354875
Molecular FormulaC11H19N3O2S
Molecular Weight257.36 g/mol
Exact Mass257.12
IUPAC NameN-(4-ethylcyclohexyl)-1H-pyrazole-4-sulfonamide
SMILESCCC1CCC(NS(=O)(=O)c2cn[nH]c2)CC1
InChIInChI=1S/C11H19N3O2S/c1-2-9-3-5-10(6-4-9)14-17(15,16)11-7-12-13-8-11/h7-10,14H,2-6H2,1H3,(H,12,13)
InChIKeyWWYZKJXGEICCAC-UHFFFAOYSA-N
XLogP1.66
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.36
LogP ≤ 51.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-cyclopropylbutan-2-yl)-1H-pyrazole-4-sulfonamide
CID 63995174
N-[1-(aminomethyl)-4-ethylcyclohexyl]-1H-pyrazole-4-sulfonamide
CID 54937046
N-(2,2-dimethyloxan-4-yl)-1H-pyrazole-4-sulfonamide
CID 113336491
4-acetyl-N-(4-ethylcyclohexyl)benzenesulfonamide
CID 61059370
3-(1H-pyrazol-4-ylsulfonylamino)cyclohexane-1-carboxylic acid
CID 63044386
N-[(4-hydroxycyclohexyl)methyl]-1H-pyrazole-4-sulfonamide
CID 106126673
N-(2-bromocyclohexyl)-1H-pyrazole-4-sulfonamide
CID 114297358
4-ethyl-N-[1-(1H-pyrazol-4-yl)ethyl]cyclohexan-1-amine
CID 103905109
N-[2-(aminomethyl)cyclopentyl]-1H-pyrazole-4-sulfonamide
CID 62955865
N-(2-chloropropyl)-1H-pyrazole-4-sulfonamide
CID 65033570
N-(2-cyclopropylpropan-2-yl)-1H-pyrazole-4-sulfonamide
CID 103697702
N-(1-pyrimidin-2-ylpiperidin-3-yl)-1H-pyrazole-4-sulfonamide
CID 61275954

Frequently Asked Questions

What is the IUPAC name of N-(4-ethylcyclohexyl)-1H-pyrazole-4-sulfonamide?
The IUPAC name of N-(4-ethylcyclohexyl)-1H-pyrazole-4-sulfonamide (CID 61354875) is N-(4-ethylcyclohexyl)-1H-pyrazole-4-sulfonamide.
What is the SMILES notation for N-(4-ethylcyclohexyl)-1H-pyrazole-4-sulfonamide?
The canonical SMILES for N-(4-ethylcyclohexyl)-1H-pyrazole-4-sulfonamide is CCC1CCC(NS(=O)(=O)c2cn[nH]c2)CC1.
What is the InChIKey of N-(4-ethylcyclohexyl)-1H-pyrazole-4-sulfonamide?
The InChIKey is WWYZKJXGEICCAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O2S/c1-2-9-3-5-10(6-4-9)14-17(15,16)11-7-12-13-8-11/h7-10,14H,2-6H2,1H3,(H,12,13).
What are the key properties of N-(4-ethylcyclohexyl)-1H-pyrazole-4-sulfonamide?
N-(4-ethylcyclohexyl)-1H-pyrazole-4-sulfonamide has a molecular weight of 257.36 g/mol, XLogP of 1.66, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethylcyclohexyl)-1H-pyrazole-4-sulfonamide is sourced from PubChem (CID 61354875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).