(3R)-N-ethyl-1-furo[3,2-c]pyridin-4-ylpyrrolidine-3-sulfonamide

C13H17N3O3S — CID 97158066

IUPAC(3R)-N-ethyl-1-furo[3,2-c]pyridin-4-ylpyrrolidine-3-sulfonamide
SMILESCCNS(=O)(=O)[C@@H]1CCN(c2nccc3occc23)C1
InChIInChI=1S/C13H17N3O3S/c1-2-15-20(17,18)10-4-7-16(9-10)13-11-5-8-19-12(11)3-6-14-13/h3,5-6,8,10,15H,2,4,7,9H2,1H3/t10-/m1/s1
InChIKeyYGTHKBQJXCGGHZ-SNVBAGLBSA-N
MW295.36 g/mol
LogP1.35
Rot. Bonds4

About (3R)-N-ethyl-1-furo[3,2-c]pyridin-4-ylpyrrolidine-3-sulfonamide

(3R)-N-ethyl-1-furo[3,2-c]pyridin-4-ylpyrrolidine-3-sulfonamide (PubChem CID 97158066) has the molecular formula C13H17N3O3S and a molecular weight of 295.36 g/mol. Its IUPAC name is (3R)-N-ethyl-1-furo[3,2-c]pyridin-4-ylpyrrolidine-3-sulfonamide.

Molecular Properties

Compound Name(3R)-N-ethyl-1-furo[3,2-c]pyridin-4-ylpyrrolidine-3-sulfonamide
PubChem CID97158066
Molecular FormulaC13H17N3O3S
Molecular Weight295.36 g/mol
Exact Mass295.10
IUPAC Name(3R)-N-ethyl-1-furo[3,2-c]pyridin-4-ylpyrrolidine-3-sulfonamide
SMILESCCNS(=O)(=O)[C@@H]1CCN(c2nccc3occc23)C1
InChIInChI=1S/C13H17N3O3S/c1-2-15-20(17,18)10-4-7-16(9-10)13-11-5-8-19-12(11)3-6-14-13/h3,5-6,8,10,15H,2,4,7,9H2,1H3/t10-/m1/s1
InChIKeyYGTHKBQJXCGGHZ-SNVBAGLBSA-N
XLogP1.35
TPSA75.44 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.36
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-furo[3,2-c]pyridin-4-yl-N-methylpyrrolidin-3-amine
CID 106535363
(3R)-1-furo[3,2-c]pyridin-4-ylpyrrolidin-3-amine
CID 129414537
4-[3-(chloromethyl)pyrrolidin-1-yl]furo[3,2-c]pyridine
CID 106535647
4-(3-bromopyrrolidin-1-yl)furo[3,2-c]pyridine
CID 106535691
methyl 1-furo[3,2-c]pyridin-4-ylpyrrolidine-3-carboxylate
CID 103702822
4-(3-chloro-4-methylpiperidin-1-yl)furo[3,2-c]pyridine
CID 106535762
N-[(1-furo[3,2-c]pyridin-4-ylpiperidin-4-yl)methyl]propan-1-amine
CID 106535576
4-(2-methyl-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-5-yl)furo[3,2-c]pyridine
CID 121185299
N-(1-furo[3,2-c]pyridin-4-ylpiperidin-3-yl)acetamide
CID 171328135
4-[(3R)-3-methylpiperazin-1-yl]furo[3,2-c]pyridine
CID 106535397
ethyl (3S)-1-furo[3,2-c]pyridin-4-ylpiperidine-3-carboxylate
CID 99636617
4-[4-[[(2R,6R)-2,6-dimethylmorpholin-4-yl]methyl]piperidin-1-yl]furo[3,2-c]pyridine
CID 97120477

Frequently Asked Questions

What is the IUPAC name of (3R)-N-ethyl-1-furo[3,2-c]pyridin-4-ylpyrrolidine-3-sulfonamide?
The IUPAC name of (3R)-N-ethyl-1-furo[3,2-c]pyridin-4-ylpyrrolidine-3-sulfonamide (CID 97158066) is (3R)-N-ethyl-1-furo[3,2-c]pyridin-4-ylpyrrolidine-3-sulfonamide.
What is the SMILES notation for (3R)-N-ethyl-1-furo[3,2-c]pyridin-4-ylpyrrolidine-3-sulfonamide?
The canonical SMILES for (3R)-N-ethyl-1-furo[3,2-c]pyridin-4-ylpyrrolidine-3-sulfonamide is CCNS(=O)(=O)[C@@H]1CCN(c2nccc3occc23)C1.
What is the InChIKey of (3R)-N-ethyl-1-furo[3,2-c]pyridin-4-ylpyrrolidine-3-sulfonamide?
The InChIKey is YGTHKBQJXCGGHZ-SNVBAGLBSA-N. The full InChI is InChI=1S/C13H17N3O3S/c1-2-15-20(17,18)10-4-7-16(9-10)13-11-5-8-19-12(11)3-6-14-13/h3,5-6,8,10,15H,2,4,7,9H2,1H3/t10-/m1/s1.
What are the key properties of (3R)-N-ethyl-1-furo[3,2-c]pyridin-4-ylpyrrolidine-3-sulfonamide?
(3R)-N-ethyl-1-furo[3,2-c]pyridin-4-ylpyrrolidine-3-sulfonamide has a molecular weight of 295.36 g/mol, XLogP of 1.35, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-ethyl-1-furo[3,2-c]pyridin-4-ylpyrrolidine-3-sulfonamide is sourced from PubChem (CID 97158066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).