5-(2-phenylpyrrolidine-1-carbonyl)furan-2-sulfonamide

C15H16N2O4S — CID 75404554

IUPAC5-(2-phenylpyrrolidine-1-carbonyl)furan-2-sulfonamide
SMILESNS(=O)(=O)c1ccc(C(=O)N2CCCC2c2ccccc2)o1
InChIInChI=1S/C15H16N2O4S/c16-22(19,20)14-9-8-13(21-14)15(18)17-10-4-7-12(17)11-5-2-1-3-6-11/h1-3,5-6,8-9,12H,4,7,10H2,(H2,16,19,20)
InChIKeyDUKCIUUQBZEBCB-UHFFFAOYSA-N
MW320.37 g/mol
LogP1.90
Rot. Bonds3

About 5-(2-phenylpyrrolidine-1-carbonyl)furan-2-sulfonamide

5-(2-phenylpyrrolidine-1-carbonyl)furan-2-sulfonamide (PubChem CID 75404554) has the molecular formula C15H16N2O4S and a molecular weight of 320.37 g/mol. Its IUPAC name is 5-(2-phenylpyrrolidine-1-carbonyl)furan-2-sulfonamide.

Molecular Properties

Compound Name5-(2-phenylpyrrolidine-1-carbonyl)furan-2-sulfonamide
PubChem CID75404554
Molecular FormulaC15H16N2O4S
Molecular Weight320.37 g/mol
Exact Mass320.08
IUPAC Name5-(2-phenylpyrrolidine-1-carbonyl)furan-2-sulfonamide
SMILESNS(=O)(=O)c1ccc(C(=O)N2CCCC2c2ccccc2)o1
InChIInChI=1S/C15H16N2O4S/c16-22(19,20)14-9-8-13(21-14)15(18)17-10-4-7-12(17)11-5-2-1-3-6-11/h1-3,5-6,8-9,12H,4,7,10H2,(H2,16,19,20)
InChIKeyDUKCIUUQBZEBCB-UHFFFAOYSA-N
XLogP1.90
TPSA93.61 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.37
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(4-sulfamoylphenyl)ethyl]furan-2-carboxamide
CID 2905675
Furan-2-carboxamide deriv., 16
CID 44236902
(4-Benzenesulfonyl-piperazin-1-yl)-furan-2-yl-methanone
CID 719657
4-Dipropylsulfamoyl-N-furan-2-ylmethyl-benzamide
CID 1128083
[4-(4-Fluoro-3-methylphenyl)sulfonylpiperazin-1-yl]-(furan-2-yl)methanone
CID 2238809
1-[(4-Butylphenyl)sulfonyl]-4-(2-furoyl)piperazine
CID 3554017
2-Furanyl-[4-(4-propan-2-ylphenyl)sulfonyl-1-piperazinyl]methanone
CID 3846584
N-Furan-2-ylmethyl-4-[(tetrahydro-furan-2-ylmethyl)-sulfamoyl]-benzamide
CID 645494
1-[(3,4-Dimethylphenyl)sulfonyl]-4-(2-furoyl)piperazine
CID 712595
[4-(2,4-Dimethylphenyl)sulfonylpiperazin-1-yl]-(furan-2-yl)methanone
CID 712596
3-Dimethylsulfamoyl-N-furan-2-ylmethyl-benzamide
CID 652389
1-Benzenesulfonyl-piperidine-4-carboxylic acid furan-2-ylmethyl-phenethyl-amide
CID 654430

Frequently Asked Questions

What is the IUPAC name of 5-(2-phenylpyrrolidine-1-carbonyl)furan-2-sulfonamide?
The IUPAC name of 5-(2-phenylpyrrolidine-1-carbonyl)furan-2-sulfonamide (CID 75404554) is 5-(2-phenylpyrrolidine-1-carbonyl)furan-2-sulfonamide.
What is the SMILES notation for 5-(2-phenylpyrrolidine-1-carbonyl)furan-2-sulfonamide?
The canonical SMILES for 5-(2-phenylpyrrolidine-1-carbonyl)furan-2-sulfonamide is NS(=O)(=O)c1ccc(C(=O)N2CCCC2c2ccccc2)o1.
What is the InChIKey of 5-(2-phenylpyrrolidine-1-carbonyl)furan-2-sulfonamide?
The InChIKey is DUKCIUUQBZEBCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O4S/c16-22(19,20)14-9-8-13(21-14)15(18)17-10-4-7-12(17)11-5-2-1-3-6-11/h1-3,5-6,8-9,12H,4,7,10H2,(H2,16,19,20).
What are the key properties of 5-(2-phenylpyrrolidine-1-carbonyl)furan-2-sulfonamide?
5-(2-phenylpyrrolidine-1-carbonyl)furan-2-sulfonamide has a molecular weight of 320.37 g/mol, XLogP of 1.90, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-phenylpyrrolidine-1-carbonyl)furan-2-sulfonamide is sourced from PubChem (CID 75404554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).