N-(1-ethylcyclobutyl)-4-(methylaminomethyl)-1H-pyrazole-5-sulfonamide

C11H20N4O2S — CID 113489224

IUPACN-(1-ethylcyclobutyl)-4-(methylaminomethyl)-1H-pyrazole-5-sulfonamide
SMILESCCC1(NS(=O)(=O)c2[nH]ncc2CNC)CCC1
InChIInChI=1S/C11H20N4O2S/c1-3-11(5-4-6-11)15-18(16,17)10-9(7-12-2)8-13-14-10/h8,12,15H,3-7H2,1-2H3,(H,13,14)
InChIKeyFPXPXZJCYKSEJS-UHFFFAOYSA-N
MW272.37 g/mol
LogP0.74
Rot. Bonds6

About N-(1-ethylcyclobutyl)-4-(methylaminomethyl)-1H-pyrazole-5-sulfonamide

N-(1-ethylcyclobutyl)-4-(methylaminomethyl)-1H-pyrazole-5-sulfonamide (PubChem CID 113489224) has the molecular formula C11H20N4O2S and a molecular weight of 272.37 g/mol. Its IUPAC name is N-(1-ethylcyclobutyl)-4-(methylaminomethyl)-1H-pyrazole-5-sulfonamide.

Molecular Properties

Compound NameN-(1-ethylcyclobutyl)-4-(methylaminomethyl)-1H-pyrazole-5-sulfonamide
PubChem CID113489224
Molecular FormulaC11H20N4O2S
Molecular Weight272.37 g/mol
Exact Mass272.13
IUPAC NameN-(1-ethylcyclobutyl)-4-(methylaminomethyl)-1H-pyrazole-5-sulfonamide
SMILESCCC1(NS(=O)(=O)c2[nH]ncc2CNC)CCC1
InChIInChI=1S/C11H20N4O2S/c1-3-11(5-4-6-11)15-18(16,17)10-9(7-12-2)8-13-14-10/h8,12,15H,3-7H2,1-2H3,(H,13,14)
InChIKeyFPXPXZJCYKSEJS-UHFFFAOYSA-N
XLogP0.74
TPSA86.88 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.37
LogP ≤ 50.74
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze N-(1-ethylcyclobutyl)-4-(methylaminomethyl)-1H-pyrazole-5-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

N-methyl-4-(propylaminomethyl)-N-(2,2,2-trifluoroethyl)-1H-pyrazole-5-sulfonamide
CID 65773206
N-methyl-4-[(propan-2-ylamino)methyl]-N-(2,2,2-trifluoroethyl)-1H-pyrazole-5-sulfonamide
CID 65773396
4-(ethylaminomethyl)-N-methyl-N-(2,2,2-trifluoroethyl)-1H-pyrazole-5-sulfonamide
CID 65774355
N-methyl-4-(methylaminomethyl)-N-(2,2,2-trifluoroethyl)-1H-pyrazole-5-sulfonamide
CID 65774539
N-cyclopropyl-4-(ethylaminomethyl)-N-(2,2,2-trifluoroethyl)-1H-pyrazole-5-sulfonamide
CID 65784240
4-[(cyclopropylamino)methyl]-N-ethyl-N-(2,2,2-trifluoroethyl)-1H-pyrazole-5-sulfonamide
CID 65784595
N-ethyl-4-(ethylaminomethyl)-N-(2,2,2-trifluoroethyl)-1H-pyrazole-5-sulfonamide
CID 65784603
4-(ethylaminomethyl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)-1H-pyrazole-5-sulfonamide
CID 65785015
4-(methylaminomethyl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)-1H-pyrazole-5-sulfonamide
CID 65785590
N-ethyl-4-(propylaminomethyl)-N-(2,2,2-trifluoroethyl)-1H-pyrazole-5-sulfonamide
CID 65785945
N-ethyl-4-[(propan-2-ylamino)methyl]-N-(2,2,2-trifluoroethyl)-1H-pyrazole-5-sulfonamide
CID 65785946
4-(ethylaminomethyl)-N-propyl-N-(2,2,2-trifluoroethyl)-1H-pyrazole-5-sulfonamide
CID 65786162

Frequently Asked Questions

What is the IUPAC name of N-(1-ethylcyclobutyl)-4-(methylaminomethyl)-1H-pyrazole-5-sulfonamide?
The IUPAC name of N-(1-ethylcyclobutyl)-4-(methylaminomethyl)-1H-pyrazole-5-sulfonamide (CID 113489224) is N-(1-ethylcyclobutyl)-4-(methylaminomethyl)-1H-pyrazole-5-sulfonamide.
What is the SMILES notation for N-(1-ethylcyclobutyl)-4-(methylaminomethyl)-1H-pyrazole-5-sulfonamide?
The canonical SMILES for N-(1-ethylcyclobutyl)-4-(methylaminomethyl)-1H-pyrazole-5-sulfonamide is CCC1(NS(=O)(=O)c2[nH]ncc2CNC)CCC1.
What is the InChIKey of N-(1-ethylcyclobutyl)-4-(methylaminomethyl)-1H-pyrazole-5-sulfonamide?
The InChIKey is FPXPXZJCYKSEJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O2S/c1-3-11(5-4-6-11)15-18(16,17)10-9(7-12-2)8-13-14-10/h8,12,15H,3-7H2,1-2H3,(H,13,14).
What are the key properties of N-(1-ethylcyclobutyl)-4-(methylaminomethyl)-1H-pyrazole-5-sulfonamide?
N-(1-ethylcyclobutyl)-4-(methylaminomethyl)-1H-pyrazole-5-sulfonamide has a molecular weight of 272.37 g/mol, XLogP of 0.74, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethylcyclobutyl)-4-(methylaminomethyl)-1H-pyrazole-5-sulfonamide is sourced from PubChem (CID 113489224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).