N-(3-cyclopentyl-1-phenylpyrazol-5-yl)-5-(difluoromethyl)furan-2-sulfonamide

C19H19F2N3O3S — CID 167827040

IUPACN-(3-cyclopentyl-1-phenylpyrazol-5-yl)-5-(difluoromethyl)furan-2-sulfonamide
SMILESO=S(=O)(Nc1cc(C2CCCC2)nn1-c1ccccc1)c1ccc(C(F)F)o1
InChIInChI=1S/C19H19F2N3O3S/c20-19(21)16-10-11-18(27-16)28(25,26)23-17-12-15(13-6-4-5-7-13)22-24(17)14-8-2-1-3-9-14/h1-3,8-13,19,23H,4-7H2
InChIKeyOFBFCRVWNAXJIV-UHFFFAOYSA-N
MW407.44 g/mol
LogP4.86
Rot. Bonds6

About N-(3-cyclopentyl-1-phenylpyrazol-5-yl)-5-(difluoromethyl)furan-2-sulfonamide

N-(3-cyclopentyl-1-phenylpyrazol-5-yl)-5-(difluoromethyl)furan-2-sulfonamide (PubChem CID 167827040) has the molecular formula C19H19F2N3O3S and a molecular weight of 407.44 g/mol. Its IUPAC name is N-(3-cyclopentyl-1-phenylpyrazol-5-yl)-5-(difluoromethyl)furan-2-sulfonamide.

Molecular Properties

Compound NameN-(3-cyclopentyl-1-phenylpyrazol-5-yl)-5-(difluoromethyl)furan-2-sulfonamide
PubChem CID167827040
Molecular FormulaC19H19F2N3O3S
Molecular Weight407.44 g/mol
Exact Mass407.11
IUPAC NameN-(3-cyclopentyl-1-phenylpyrazol-5-yl)-5-(difluoromethyl)furan-2-sulfonamide
SMILESO=S(=O)(Nc1cc(C2CCCC2)nn1-c1ccccc1)c1ccc(C(F)F)o1
InChIInChI=1S/C19H19F2N3O3S/c20-19(21)16-10-11-18(27-16)28(25,26)23-17-12-15(13-6-4-5-7-13)22-24(17)14-8-2-1-3-9-14/h1-3,8-13,19,23H,4-7H2
InChIKeyOFBFCRVWNAXJIV-UHFFFAOYSA-N
XLogP4.86
TPSA77.13 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500407.44
LogP ≤ 54.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[3-(5-tert-butyl-2-methylfuran-3-yl)-1-(3,5-dimethylphenyl)pyrazol-5-yl]-3-fluorobenzenesulfonamide
CID 2742798
4-[5-Amino-3-(5-tert-butyl-2-methylfuran-3-yl)pyrazol-1-yl]benzenesulfonamide
CID 2742753
5-(tert-butylsulfamoyl)-N-[5-methyl-2-[3-(trifluoromethyl)phenyl]pyrazol-3-yl]furan-2-carboxamide
CID 55668556
N-(3-cyclopentyl-1-phenylpyrazol-5-yl)-5-fluoro-3-methyl-1-benzofuran-2-sulfonamide
CID 167843378
4-[5-[2-(5-Amino-4-cyano-1-phenylpyrazol-3-yl)-2-cyanoethenyl]furan-2-yl]benzenesulfonamide
CID 3444456
4-[5-[(Z)-2-(5-amino-4-cyano-1-phenylpyrazol-3-yl)-2-cyanoethenyl]furan-2-yl]benzenesulfonamide
CID 5828198
N-[3-(2,2-dimethylpropyl)-1-methylpyrazol-5-yl]-5-methylfuran-2-sulfonamide
CID 132376347
Methyl 2,5-dimethyl-4-[(5-methyl-2-phenylpyrazol-3-yl)sulfamoyl]furan-3-carboxylate
CID 167852229

Frequently Asked Questions

What is the IUPAC name of N-(3-cyclopentyl-1-phenylpyrazol-5-yl)-5-(difluoromethyl)furan-2-sulfonamide?
The IUPAC name of N-(3-cyclopentyl-1-phenylpyrazol-5-yl)-5-(difluoromethyl)furan-2-sulfonamide (CID 167827040) is N-(3-cyclopentyl-1-phenylpyrazol-5-yl)-5-(difluoromethyl)furan-2-sulfonamide.
What is the SMILES notation for N-(3-cyclopentyl-1-phenylpyrazol-5-yl)-5-(difluoromethyl)furan-2-sulfonamide?
The canonical SMILES for N-(3-cyclopentyl-1-phenylpyrazol-5-yl)-5-(difluoromethyl)furan-2-sulfonamide is O=S(=O)(Nc1cc(C2CCCC2)nn1-c1ccccc1)c1ccc(C(F)F)o1.
What is the InChIKey of N-(3-cyclopentyl-1-phenylpyrazol-5-yl)-5-(difluoromethyl)furan-2-sulfonamide?
The InChIKey is OFBFCRVWNAXJIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19F2N3O3S/c20-19(21)16-10-11-18(27-16)28(25,26)23-17-12-15(13-6-4-5-7-13)22-24(17)14-8-2-1-3-9-14/h1-3,8-13,19,23H,4-7H2.
What are the key properties of N-(3-cyclopentyl-1-phenylpyrazol-5-yl)-5-(difluoromethyl)furan-2-sulfonamide?
N-(3-cyclopentyl-1-phenylpyrazol-5-yl)-5-(difluoromethyl)furan-2-sulfonamide has a molecular weight of 407.44 g/mol, XLogP of 4.86, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyclopentyl-1-phenylpyrazol-5-yl)-5-(difluoromethyl)furan-2-sulfonamide is sourced from PubChem (CID 167827040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).