[2-(furan-2-yl)pyrrolidin-1-yl]-(5-methylsulfonylfuran-2-yl)methanone

C14H15NO5S — CID 86960921

IUPAC[2-(furan-2-yl)pyrrolidin-1-yl]-(5-methylsulfonylfuran-2-yl)methanone
SMILESCS(=O)(=O)c1ccc(C(=O)N2CCCC2c2ccco2)o1
InChIInChI=1S/C14H15NO5S/c1-21(17,18)13-7-6-12(20-13)14(16)15-8-2-4-10(15)11-5-3-9-19-11/h3,5-7,9-10H,2,4,8H2,1H3
InChIKeyHEYWKZYJEWMORJ-UHFFFAOYSA-N
MW309.34 g/mol
LogP2.25
Rot. Bonds3

About [2-(furan-2-yl)pyrrolidin-1-yl]-(5-methylsulfonylfuran-2-yl)methanone

[2-(furan-2-yl)pyrrolidin-1-yl]-(5-methylsulfonylfuran-2-yl)methanone (PubChem CID 86960921) has the molecular formula C14H15NO5S and a molecular weight of 309.34 g/mol. Its IUPAC name is [2-(furan-2-yl)pyrrolidin-1-yl]-(5-methylsulfonylfuran-2-yl)methanone.

Molecular Properties

Compound Name[2-(furan-2-yl)pyrrolidin-1-yl]-(5-methylsulfonylfuran-2-yl)methanone
PubChem CID86960921
Molecular FormulaC14H15NO5S
Molecular Weight309.34 g/mol
Exact Mass309.07
IUPAC Name[2-(furan-2-yl)pyrrolidin-1-yl]-(5-methylsulfonylfuran-2-yl)methanone
SMILESCS(=O)(=O)c1ccc(C(=O)N2CCCC2c2ccco2)o1
InChIInChI=1S/C14H15NO5S/c1-21(17,18)13-7-6-12(20-13)14(16)15-8-2-4-10(15)11-5-3-9-19-11/h3,5-7,9-10H,2,4,8H2,1H3
InChIKeyHEYWKZYJEWMORJ-UHFFFAOYSA-N
XLogP2.25
TPSA80.73 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.34
LogP ≤ 52.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze [2-(furan-2-yl)pyrrolidin-1-yl]-(5-methylsulfonylfuran-2-yl)methanone 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-[(2R)-2-(furan-2-yl)pyrrolidin-1-yl]ethanone
CID 124500835
[2-(furan-2-yl)azepan-1-yl]-[5-(methylsulfanylmethyl)furan-2-yl]methanone
CID 70706464
4-[(2S)-2-(furan-2-yl)pyrrolidine-1-carbonyl]benzoic acid
CID 124701060
5-[(2S,4R)-2-(furan-2-yl)-4-methylpiperidine-1-carbonyl]furan-2-carboxylic acid
CID 124692737
[(2S)-2-(furan-2-yl)pyrrolidin-1-yl]-(3-phenyl-1,2-oxazol-5-yl)methanone
CID 51550762
(4-ethylsulfonylphenyl)-[(2R)-2-(furan-2-yl)piperidin-1-yl]methanone
CID 95352268
3-[(2S)-2-(furan-2-yl)pyrrolidine-1-carbonyl]-N-methylbenzenesulfonamide
CID 99297656
(2-chloro-4,5-difluorophenyl)-[2-(furan-2-yl)pyrrolidin-1-yl]methanone
CID 20895629
(2,3-dimethyl-1H-indol-5-yl)-[2-(furan-2-yl)pyrrolidin-1-yl]methanone
CID 72898684
1-[2-(furan-2-yl)pyrrolidin-1-yl]prop-2-en-1-one
CID 51346068
[(2R)-2-(furan-2-yl)pyrrolidin-1-yl]-(2-methyl-1,3-thiazol-4-yl)methanone
CID 97453901
[(2R)-2-(furan-2-yl)pyrrolidin-1-yl]-(5-propan-2-yl-1,2-oxazol-3-yl)methanone
CID 92721203

Frequently Asked Questions

What is the IUPAC name of [2-(furan-2-yl)pyrrolidin-1-yl]-(5-methylsulfonylfuran-2-yl)methanone?
The IUPAC name of [2-(furan-2-yl)pyrrolidin-1-yl]-(5-methylsulfonylfuran-2-yl)methanone (CID 86960921) is [2-(furan-2-yl)pyrrolidin-1-yl]-(5-methylsulfonylfuran-2-yl)methanone.
What is the SMILES notation for [2-(furan-2-yl)pyrrolidin-1-yl]-(5-methylsulfonylfuran-2-yl)methanone?
The canonical SMILES for [2-(furan-2-yl)pyrrolidin-1-yl]-(5-methylsulfonylfuran-2-yl)methanone is CS(=O)(=O)c1ccc(C(=O)N2CCCC2c2ccco2)o1.
What is the InChIKey of [2-(furan-2-yl)pyrrolidin-1-yl]-(5-methylsulfonylfuran-2-yl)methanone?
The InChIKey is HEYWKZYJEWMORJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO5S/c1-21(17,18)13-7-6-12(20-13)14(16)15-8-2-4-10(15)11-5-3-9-19-11/h3,5-7,9-10H,2,4,8H2,1H3.
What are the key properties of [2-(furan-2-yl)pyrrolidin-1-yl]-(5-methylsulfonylfuran-2-yl)methanone?
[2-(furan-2-yl)pyrrolidin-1-yl]-(5-methylsulfonylfuran-2-yl)methanone has a molecular weight of 309.34 g/mol, XLogP of 2.25, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(furan-2-yl)pyrrolidin-1-yl]-(5-methylsulfonylfuran-2-yl)methanone is sourced from PubChem (CID 86960921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).