1-(2,2-difluoroethyl)-N-piperidin-3-ylpyrazole-4-sulfonamide;hydrochloride

C10H17ClF2N4O2S — CID 120707191

IUPAC1-(2,2-difluoroethyl)-N-piperidin-3-ylpyrazole-4-sulfonamide;hydrochloride
SMILESCl.O=S(=O)(NC1CCCNC1)c1cnn(CC(F)F)c1
InChIInChI=1S/C10H16F2N4O2S.ClH/c11-10(12)7-16-6-9(5-14-16)19(17,18)15-8-2-1-3-13-4-8;/h5-6,8,10,13,15H,1-4,7H2;1H
InChIKeyGGGDZKQHPCSJSP-UHFFFAOYSA-N
MW330.79 g/mol
LogP0.60
Rot. Bonds5

About 1-(2,2-difluoroethyl)-N-piperidin-3-ylpyrazole-4-sulfonamide;hydrochloride

1-(2,2-difluoroethyl)-N-piperidin-3-ylpyrazole-4-sulfonamide;hydrochloride (PubChem CID 120707191) has the molecular formula C10H17ClF2N4O2S and a molecular weight of 330.79 g/mol. Its IUPAC name is 1-(2,2-difluoroethyl)-N-piperidin-3-ylpyrazole-4-sulfonamide;hydrochloride.

Molecular Properties

Compound Name1-(2,2-difluoroethyl)-N-piperidin-3-ylpyrazole-4-sulfonamide;hydrochloride
PubChem CID120707191
Molecular FormulaC10H17ClF2N4O2S
Molecular Weight330.79 g/mol
Exact Mass330.07
IUPAC Name1-(2,2-difluoroethyl)-N-piperidin-3-ylpyrazole-4-sulfonamide;hydrochloride
SMILESCl.O=S(=O)(NC1CCCNC1)c1cnn(CC(F)F)c1
InChIInChI=1S/C10H16F2N4O2S.ClH/c11-10(12)7-16-6-9(5-14-16)19(17,18)15-8-2-1-3-13-4-8;/h5-6,8,10,13,15H,1-4,7H2;1H
InChIKeyGGGDZKQHPCSJSP-UHFFFAOYSA-N
XLogP0.60
TPSA76.02 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.79
LogP ≤ 50.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 1-(2,2-difluoroethyl)-N-piperidin-3-ylpyrazole-4-sulfonamide;hydrochloride 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

1-(2,2-difluoroethyl)-N-pyrrolidin-3-ylpyrazole-4-sulfonamide;hydrochloride
CID 120707652
N-pyrrolidin-3-yl-1-(2,2,2-trifluoroethyl)pyrazole-4-sulfonamide;hydrochloride
CID 120707592
4-(2,2-difluoroethoxy)-N-piperidin-3-ylbenzenesulfonamide;hydrochloride
CID 120707154
5-fluoro-N-[(3S)-piperidin-3-yl]pyridine-3-sulfonamide
CID 95400234
4-chloro-N-piperidin-3-ylbenzenesulfonamide;hydrochloride
CID 119964099
N-[(3S)-piperidin-3-yl]-4-(trifluoromethyl)benzenesulfonamide;hydrochloride
CID 120716651
4-(2-methylpropyl)-N-piperidin-3-ylbenzenesulfonamide;hydrochloride
CID 119964495
N-piperidin-3-yl-4-(trifluoromethyl)benzenesulfonamide
CID 63321069
4-cyano-N-[(3R)-piperidin-3-yl]benzenesulfonamide;hydrochloride
CID 120723595
3-fluoro-4-methoxy-N-[(3S)-piperidin-3-yl]benzenesulfonamide
CID 104982668
1-(2,2-difluoroethyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]pyrazole-4-sulfonamide
CID 120896419
4-methoxy-N-piperidin-3-ylbenzenesulfonamide;hydrochloride
CID 119964408

Frequently Asked Questions

What is the IUPAC name of 1-(2,2-difluoroethyl)-N-piperidin-3-ylpyrazole-4-sulfonamide;hydrochloride?
The IUPAC name of 1-(2,2-difluoroethyl)-N-piperidin-3-ylpyrazole-4-sulfonamide;hydrochloride (CID 120707191) is 1-(2,2-difluoroethyl)-N-piperidin-3-ylpyrazole-4-sulfonamide;hydrochloride.
What is the SMILES notation for 1-(2,2-difluoroethyl)-N-piperidin-3-ylpyrazole-4-sulfonamide;hydrochloride?
The canonical SMILES for 1-(2,2-difluoroethyl)-N-piperidin-3-ylpyrazole-4-sulfonamide;hydrochloride is Cl.O=S(=O)(NC1CCCNC1)c1cnn(CC(F)F)c1.
What is the InChIKey of 1-(2,2-difluoroethyl)-N-piperidin-3-ylpyrazole-4-sulfonamide;hydrochloride?
The InChIKey is GGGDZKQHPCSJSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16F2N4O2S.ClH/c11-10(12)7-16-6-9(5-14-16)19(17,18)15-8-2-1-3-13-4-8;/h5-6,8,10,13,15H,1-4,7H2;1H.
What are the key properties of 1-(2,2-difluoroethyl)-N-piperidin-3-ylpyrazole-4-sulfonamide;hydrochloride?
1-(2,2-difluoroethyl)-N-piperidin-3-ylpyrazole-4-sulfonamide;hydrochloride has a molecular weight of 330.79 g/mol, XLogP of 0.60, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-difluoroethyl)-N-piperidin-3-ylpyrazole-4-sulfonamide;hydrochloride is sourced from PubChem (CID 120707191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).