N-cyclopentyl-1-(difluoromethyl)-3,5-dimethylpyrazole-4-sulfonamide

C11H17F2N3O2S — CID 19582811

IUPACN-cyclopentyl-1-(difluoromethyl)-3,5-dimethylpyrazole-4-sulfonamide
SMILESCc1nn(C(F)F)c(C)c1S(=O)(=O)NC1CCCC1
InChIInChI=1S/C11H17F2N3O2S/c1-7-10(8(2)16(14-7)11(12)13)19(17,18)15-9-5-3-4-6-9/h9,11,15H,3-6H2,1-2H3
InChIKeyFEHOMFHPJLLZPS-UHFFFAOYSA-N
MW293.34 g/mol
LogP2.12
Rot. Bonds4

About N-cyclopentyl-1-(difluoromethyl)-3,5-dimethylpyrazole-4-sulfonamide

N-cyclopentyl-1-(difluoromethyl)-3,5-dimethylpyrazole-4-sulfonamide (PubChem CID 19582811) has the molecular formula C11H17F2N3O2S and a molecular weight of 293.34 g/mol. Its IUPAC name is N-cyclopentyl-1-(difluoromethyl)-3,5-dimethylpyrazole-4-sulfonamide.

Molecular Properties

Compound NameN-cyclopentyl-1-(difluoromethyl)-3,5-dimethylpyrazole-4-sulfonamide
PubChem CID19582811
Molecular FormulaC11H17F2N3O2S
Molecular Weight293.34 g/mol
Exact Mass293.10
IUPAC NameN-cyclopentyl-1-(difluoromethyl)-3,5-dimethylpyrazole-4-sulfonamide
SMILESCc1nn(C(F)F)c(C)c1S(=O)(=O)NC1CCCC1
InChIInChI=1S/C11H17F2N3O2S/c1-7-10(8(2)16(14-7)11(12)13)19(17,18)15-9-5-3-4-6-9/h9,11,15H,3-6H2,1-2H3
InChIKeyFEHOMFHPJLLZPS-UHFFFAOYSA-N
XLogP2.12
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.34
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-1-(difluoromethyl)-3,5-dimethylpyrazole-4-sulfonamide?
The IUPAC name of N-cyclopentyl-1-(difluoromethyl)-3,5-dimethylpyrazole-4-sulfonamide (CID 19582811) is N-cyclopentyl-1-(difluoromethyl)-3,5-dimethylpyrazole-4-sulfonamide.
What is the SMILES notation for N-cyclopentyl-1-(difluoromethyl)-3,5-dimethylpyrazole-4-sulfonamide?
The canonical SMILES for N-cyclopentyl-1-(difluoromethyl)-3,5-dimethylpyrazole-4-sulfonamide is Cc1nn(C(F)F)c(C)c1S(=O)(=O)NC1CCCC1.
What is the InChIKey of N-cyclopentyl-1-(difluoromethyl)-3,5-dimethylpyrazole-4-sulfonamide?
The InChIKey is FEHOMFHPJLLZPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17F2N3O2S/c1-7-10(8(2)16(14-7)11(12)13)19(17,18)15-9-5-3-4-6-9/h9,11,15H,3-6H2,1-2H3.
What are the key properties of N-cyclopentyl-1-(difluoromethyl)-3,5-dimethylpyrazole-4-sulfonamide?
N-cyclopentyl-1-(difluoromethyl)-3,5-dimethylpyrazole-4-sulfonamide has a molecular weight of 293.34 g/mol, XLogP of 2.12, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-1-(difluoromethyl)-3,5-dimethylpyrazole-4-sulfonamide is sourced from PubChem (CID 19582811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).