3-amino-N-(2,2-dimethylcyclopentyl)-1-ethylpyrazole-4-sulfonamide

C12H22N4O2S — CID 79861218

IUPAC3-amino-N-(2,2-dimethylcyclopentyl)-1-ethylpyrazole-4-sulfonamide
SMILESCCn1cc(S(=O)(=O)NC2CCCC2(C)C)c(N)n1
InChIInChI=1S/C12H22N4O2S/c1-4-16-8-9(11(13)14-16)19(17,18)15-10-6-5-7-12(10,2)3/h8,10,15H,4-7H2,1-3H3,(H2,13,14)
InChIKeyTVWMIQJLEOQTCH-UHFFFAOYSA-N
MW286.40 g/mol
LogP1.34
Rot. Bonds4

About 3-amino-N-(2,2-dimethylcyclopentyl)-1-ethylpyrazole-4-sulfonamide

3-amino-N-(2,2-dimethylcyclopentyl)-1-ethylpyrazole-4-sulfonamide (PubChem CID 79861218) has the molecular formula C12H22N4O2S and a molecular weight of 286.40 g/mol. Its IUPAC name is 3-amino-N-(2,2-dimethylcyclopentyl)-1-ethylpyrazole-4-sulfonamide.

Molecular Properties

Compound Name3-amino-N-(2,2-dimethylcyclopentyl)-1-ethylpyrazole-4-sulfonamide
PubChem CID79861218
Molecular FormulaC12H22N4O2S
Molecular Weight286.40 g/mol
Exact Mass286.15
IUPAC Name3-amino-N-(2,2-dimethylcyclopentyl)-1-ethylpyrazole-4-sulfonamide
SMILESCCn1cc(S(=O)(=O)NC2CCCC2(C)C)c(N)n1
InChIInChI=1S/C12H22N4O2S/c1-4-16-8-9(11(13)14-16)19(17,18)15-10-6-5-7-12(10,2)3/h8,10,15H,4-7H2,1-3H3,(H2,13,14)
InChIKeyTVWMIQJLEOQTCH-UHFFFAOYSA-N
XLogP1.34
TPSA90.01 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.40
LogP ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 3-amino-N-(2,2-dimethylcyclopentyl)-1-ethylpyrazole-4-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-amino-N-cyclooctyl-1-ethylpyrazole-4-sulfonamide
CID 60808927
3-amino-1-ethyl-N-(3-hydroxy-2,2-dimethylcyclobutyl)pyrazole-4-sulfonamide
CID 114628479
3-amino-1-ethyl-N-(2-methoxycyclopentyl)pyrazole-4-sulfonamide
CID 62087291
3-amino-1-ethyl-N-[2-(hydroxymethyl)cyclopentyl]pyrazole-4-sulfonamide
CID 106358780
3-amino-1-ethyl-N-(1-ethylcyclobutyl)pyrazole-4-sulfonamide
CID 113488577
3-amino-N-cyclopentyl-1-propylpyrazole-4-sulfonamide
CID 54922795
3-amino-1-ethyl-N-(1-methyl-6-oxopiperidin-3-yl)pyrazole-4-sulfonamide
CID 64656103
3-amino-1-ethyl-N-piperidin-1-ylpyrazole-4-sulfonamide
CID 83012354
3-amino-N-tert-butyl-1-ethylpyrazole-4-sulfonamide
CID 60814031
3-amino-1-ethyl-N-(oxolan-3-ylmethyl)pyrazole-4-sulfonamide
CID 61114804
2-amino-N-(2,2-dimethylcyclopentyl)-4-methylbenzenesulfonamide
CID 79861056
5-amino-N-(2,2-dimethylcyclopentyl)-2,3-dimethylbenzenesulfonamide
CID 79860965

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2,2-dimethylcyclopentyl)-1-ethylpyrazole-4-sulfonamide?
The IUPAC name of 3-amino-N-(2,2-dimethylcyclopentyl)-1-ethylpyrazole-4-sulfonamide (CID 79861218) is 3-amino-N-(2,2-dimethylcyclopentyl)-1-ethylpyrazole-4-sulfonamide.
What is the SMILES notation for 3-amino-N-(2,2-dimethylcyclopentyl)-1-ethylpyrazole-4-sulfonamide?
The canonical SMILES for 3-amino-N-(2,2-dimethylcyclopentyl)-1-ethylpyrazole-4-sulfonamide is CCn1cc(S(=O)(=O)NC2CCCC2(C)C)c(N)n1.
What is the InChIKey of 3-amino-N-(2,2-dimethylcyclopentyl)-1-ethylpyrazole-4-sulfonamide?
The InChIKey is TVWMIQJLEOQTCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4O2S/c1-4-16-8-9(11(13)14-16)19(17,18)15-10-6-5-7-12(10,2)3/h8,10,15H,4-7H2,1-3H3,(H2,13,14).
What are the key properties of 3-amino-N-(2,2-dimethylcyclopentyl)-1-ethylpyrazole-4-sulfonamide?
3-amino-N-(2,2-dimethylcyclopentyl)-1-ethylpyrazole-4-sulfonamide has a molecular weight of 286.40 g/mol, XLogP of 1.34, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2,2-dimethylcyclopentyl)-1-ethylpyrazole-4-sulfonamide is sourced from PubChem (CID 79861218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).