(2R)-1-(benzenesulfonyl)-2-(furan-2-yl)pyrrolidine

C14H15NO3S — CID 51550819

IUPAC(2R)-1-(benzenesulfonyl)-2-(furan-2-yl)pyrrolidine
SMILESO=S(=O)(c1ccccc1)N1CCC[C@@H]1c1ccco1
InChIInChI=1S/C14H15NO3S/c16-19(17,12-6-2-1-3-7-12)15-10-4-8-13(15)14-9-5-11-18-14/h1-3,5-7,9,11,13H,4,8,10H2/t13-/m1/s1
InChIKeyYZGUQNHERBBJOP-CYBMUJFWSA-N
MW277.34 g/mol
LogP2.81
Rot. Bonds3

About (2R)-1-(benzenesulfonyl)-2-(furan-2-yl)pyrrolidine

(2R)-1-(benzenesulfonyl)-2-(furan-2-yl)pyrrolidine (PubChem CID 51550819) has the molecular formula C14H15NO3S and a molecular weight of 277.34 g/mol. Its IUPAC name is (2R)-1-(benzenesulfonyl)-2-(furan-2-yl)pyrrolidine.

Molecular Properties

Compound Name(2R)-1-(benzenesulfonyl)-2-(furan-2-yl)pyrrolidine
PubChem CID51550819
Molecular FormulaC14H15NO3S
Molecular Weight277.34 g/mol
Exact Mass277.08
IUPAC Name(2R)-1-(benzenesulfonyl)-2-(furan-2-yl)pyrrolidine
SMILESO=S(=O)(c1ccccc1)N1CCC[C@@H]1c1ccco1
InChIInChI=1S/C14H15NO3S/c16-19(17,12-6-2-1-3-7-12)15-10-4-8-13(15)14-9-5-11-18-14/h1-3,5-7,9,11,13H,4,8,10H2/t13-/m1/s1
InChIKeyYZGUQNHERBBJOP-CYBMUJFWSA-N
XLogP2.81
TPSA50.52 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.34
LogP ≤ 52.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(benzenesulfonyl)-2-(furan-2-yl)pyrrolidine
CID 20895729
(2S)-2-(furan-2-yl)-1-(4-methylphenyl)sulfonylpyrrolidine
CID 51550818
N-[4-[2-(furan-2-yl)pyrrolidin-1-yl]sulfonylphenyl]acetamide
CID 20895730
(2S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-2-(furan-2-yl)pyrrolidine
CID 99324019
1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-2-(furan-2-yl)pyrrolidine
CID 126772153
2-[(2R)-1-[(2R)-2-(furan-2-yl)pyrrolidin-1-yl]sulfonylpyrrolidin-2-yl]pyridine
CID 97018175
2-[(2S)-1-[(2S)-2-(furan-2-yl)pyrrolidin-1-yl]sulfonylpyrrolidin-2-yl]pyridine
CID 124733704
(2R)-1-(3-chloro-4-methoxyphenyl)sulfonyl-2-(furan-2-yl)pyrrolidine
CID 51550831
2,3-difluoro-5-[2-(furan-2-yl)azepan-1-yl]sulfonylbenzoic acid
CID 167896052
6-[2-(furan-2-yl)pyrrolidin-1-yl]sulfonyl-4-oxo-1H-quinoline-3-carboxylic acid
CID 20895736
(2S)-2-(furan-2-yl)-1-[(3S)-3-phenylpyrrolidin-1-yl]sulfonylpyrrolidine
CID 124865657
4-[(2S)-2-(furan-2-yl)pyrrolidin-1-yl]sulfonyl-1,2-dimethylimidazole
CID 95770618

Frequently Asked Questions

What is the IUPAC name of (2R)-1-(benzenesulfonyl)-2-(furan-2-yl)pyrrolidine?
The IUPAC name of (2R)-1-(benzenesulfonyl)-2-(furan-2-yl)pyrrolidine (CID 51550819) is (2R)-1-(benzenesulfonyl)-2-(furan-2-yl)pyrrolidine.
What is the SMILES notation for (2R)-1-(benzenesulfonyl)-2-(furan-2-yl)pyrrolidine?
The canonical SMILES for (2R)-1-(benzenesulfonyl)-2-(furan-2-yl)pyrrolidine is O=S(=O)(c1ccccc1)N1CCC[C@@H]1c1ccco1.
What is the InChIKey of (2R)-1-(benzenesulfonyl)-2-(furan-2-yl)pyrrolidine?
The InChIKey is YZGUQNHERBBJOP-CYBMUJFWSA-N. The full InChI is InChI=1S/C14H15NO3S/c16-19(17,12-6-2-1-3-7-12)15-10-4-8-13(15)14-9-5-11-18-14/h1-3,5-7,9,11,13H,4,8,10H2/t13-/m1/s1.
What are the key properties of (2R)-1-(benzenesulfonyl)-2-(furan-2-yl)pyrrolidine?
(2R)-1-(benzenesulfonyl)-2-(furan-2-yl)pyrrolidine has a molecular weight of 277.34 g/mol, XLogP of 2.81, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-(benzenesulfonyl)-2-(furan-2-yl)pyrrolidine is sourced from PubChem (CID 51550819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).