2-[(2R)-1-[(2R)-2-(furan-2-yl)pyrrolidin-1-yl]sulfonylpyrrolidin-2-yl]pyridine

C17H21N3O3S — CID 97018175

IUPAC2-[(2R)-1-[(2R)-2-(furan-2-yl)pyrrolidin-1-yl]sulfonylpyrrolidin-2-yl]pyridine
SMILESO=S(=O)(N1CCC[C@@H]1c1ccccn1)N1CCC[C@@H]1c1ccco1
InChIInChI=1S/C17H21N3O3S/c21-24(22,20-12-4-8-16(20)17-9-5-13-23-17)19-11-3-7-15(19)14-6-1-2-10-18-14/h1-2,5-6,9-10,13,15-16H,3-4,7-8,11-12H2/t15-,16-/m1/s1
InChIKeyLJWUTBNDJNVIDM-HZPDHXFCSA-N
MW347.44 g/mol
LogP2.89
Rot. Bonds4

About 2-[(2R)-1-[(2R)-2-(furan-2-yl)pyrrolidin-1-yl]sulfonylpyrrolidin-2-yl]pyridine

2-[(2R)-1-[(2R)-2-(furan-2-yl)pyrrolidin-1-yl]sulfonylpyrrolidin-2-yl]pyridine (PubChem CID 97018175) has the molecular formula C17H21N3O3S and a molecular weight of 347.44 g/mol. Its IUPAC name is 2-[(2R)-1-[(2R)-2-(furan-2-yl)pyrrolidin-1-yl]sulfonylpyrrolidin-2-yl]pyridine.

Molecular Properties

Compound Name2-[(2R)-1-[(2R)-2-(furan-2-yl)pyrrolidin-1-yl]sulfonylpyrrolidin-2-yl]pyridine
PubChem CID97018175
Molecular FormulaC17H21N3O3S
Molecular Weight347.44 g/mol
Exact Mass347.13
IUPAC Name2-[(2R)-1-[(2R)-2-(furan-2-yl)pyrrolidin-1-yl]sulfonylpyrrolidin-2-yl]pyridine
SMILESO=S(=O)(N1CCC[C@@H]1c1ccccn1)N1CCC[C@@H]1c1ccco1
InChIInChI=1S/C17H21N3O3S/c21-24(22,20-12-4-8-16(20)17-9-5-13-23-17)19-11-3-7-15(19)14-6-1-2-10-18-14/h1-2,5-6,9-10,13,15-16H,3-4,7-8,11-12H2/t15-,16-/m1/s1
InChIKeyLJWUTBNDJNVIDM-HZPDHXFCSA-N
XLogP2.89
TPSA66.65 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.44
LogP ≤ 52.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-[(2R)-1-[(2R)-2-(furan-2-yl)pyrrolidin-1-yl]sulfonylpyrrolidin-2-yl]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[(2R)-1-[(2R)-2-(furan-2-yl)pyrrolidin-1-yl]sulfonylpyrrolidin-2-yl]pyridine?
The IUPAC name of 2-[(2R)-1-[(2R)-2-(furan-2-yl)pyrrolidin-1-yl]sulfonylpyrrolidin-2-yl]pyridine (CID 97018175) is 2-[(2R)-1-[(2R)-2-(furan-2-yl)pyrrolidin-1-yl]sulfonylpyrrolidin-2-yl]pyridine.
What is the SMILES notation for 2-[(2R)-1-[(2R)-2-(furan-2-yl)pyrrolidin-1-yl]sulfonylpyrrolidin-2-yl]pyridine?
The canonical SMILES for 2-[(2R)-1-[(2R)-2-(furan-2-yl)pyrrolidin-1-yl]sulfonylpyrrolidin-2-yl]pyridine is O=S(=O)(N1CCC[C@@H]1c1ccccn1)N1CCC[C@@H]1c1ccco1.
What is the InChIKey of 2-[(2R)-1-[(2R)-2-(furan-2-yl)pyrrolidin-1-yl]sulfonylpyrrolidin-2-yl]pyridine?
The InChIKey is LJWUTBNDJNVIDM-HZPDHXFCSA-N. The full InChI is InChI=1S/C17H21N3O3S/c21-24(22,20-12-4-8-16(20)17-9-5-13-23-17)19-11-3-7-15(19)14-6-1-2-10-18-14/h1-2,5-6,9-10,13,15-16H,3-4,7-8,11-12H2/t15-,16-/m1/s1.
What are the key properties of 2-[(2R)-1-[(2R)-2-(furan-2-yl)pyrrolidin-1-yl]sulfonylpyrrolidin-2-yl]pyridine?
2-[(2R)-1-[(2R)-2-(furan-2-yl)pyrrolidin-1-yl]sulfonylpyrrolidin-2-yl]pyridine has a molecular weight of 347.44 g/mol, XLogP of 2.89, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2R)-1-[(2R)-2-(furan-2-yl)pyrrolidin-1-yl]sulfonylpyrrolidin-2-yl]pyridine is sourced from PubChem (CID 97018175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).