4-[(3S,4R)-3,4-difluoropyrrolidin-1-yl]furo[3,2-c]pyridine

C11H10F2N2O — CID 138039104

IUPAC4-[(3S,4R)-3,4-difluoropyrrolidin-1-yl]furo[3,2-c]pyridine
SMILESF[C@@H]1CN(c2nccc3occc23)C[C@@H]1F
InChIInChI=1S/C11H10F2N2O/c12-8-5-15(6-9(8)13)11-7-2-4-16-10(7)1-3-14-11/h1-4,8-9H,5-6H2/t8-,9+
InChIKeyYSPHQDUGAQVXEV-DTORHVGOSA-N
MW224.21 g/mol
LogP2.32
Rot. Bonds1

About 4-[(3S,4R)-3,4-difluoropyrrolidin-1-yl]furo[3,2-c]pyridine

4-[(3S,4R)-3,4-difluoropyrrolidin-1-yl]furo[3,2-c]pyridine (PubChem CID 138039104) has the molecular formula C11H10F2N2O and a molecular weight of 224.21 g/mol. Its IUPAC name is 4-[(3S,4R)-3,4-difluoropyrrolidin-1-yl]furo[3,2-c]pyridine.

Molecular Properties

Compound Name4-[(3S,4R)-3,4-difluoropyrrolidin-1-yl]furo[3,2-c]pyridine
PubChem CID138039104
Molecular FormulaC11H10F2N2O
Molecular Weight224.21 g/mol
Exact Mass224.08
IUPAC Name4-[(3S,4R)-3,4-difluoropyrrolidin-1-yl]furo[3,2-c]pyridine
SMILESF[C@@H]1CN(c2nccc3occc23)C[C@@H]1F
InChIInChI=1S/C11H10F2N2O/c12-8-5-15(6-9(8)13)11-7-2-4-16-10(7)1-3-14-11/h1-4,8-9H,5-6H2/t8-,9+
InChIKeyYSPHQDUGAQVXEV-DTORHVGOSA-N
XLogP2.32
TPSA29.27 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.21
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 4-[(3S,4R)-3,4-difluoropyrrolidin-1-yl]furo[3,2-c]pyridine with MolForge

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Related Compounds

4-(2,6-dimethylmorpholin-4-yl)furo[3,2-c]pyridine
CID 123630821
4-(2-methyl-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-5-yl)furo[3,2-c]pyridine
CID 121185299
(3R)-1-furo[3,2-c]pyridin-4-ylpyrrolidin-3-amine
CID 129414537
4-(3-piperazin-1-ylazetidin-1-yl)furo[3,2-c]pyridine
CID 106535332
4-(3-bromopyrrolidin-1-yl)furo[3,2-c]pyridine
CID 106535691
4-(2,2-difluoro-6-azaspiro[2.5]octan-6-yl)furo[3,2-c]pyridine
CID 172900403
4-[(3R)-3-methylpiperazin-1-yl]furo[3,2-c]pyridine
CID 106535397
1-furo[3,2-c]pyridin-4-yl-N-methylpyrrolidin-3-amine
CID 106535363
4-[3-(chloromethyl)pyrrolidin-1-yl]furo[3,2-c]pyridine
CID 106535647
4-piperazin-1-ylfuro[3,2-c]pyridine;dihydrochloride
CID 134830355
4-(3-chloro-4-methylpiperidin-1-yl)furo[3,2-c]pyridine
CID 106535762
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 4-[(3S,4R)-3,4-difluoropyrrolidin-1-yl]furo[3,2-c]pyridine?
The IUPAC name of 4-[(3S,4R)-3,4-difluoropyrrolidin-1-yl]furo[3,2-c]pyridine (CID 138039104) is 4-[(3S,4R)-3,4-difluoropyrrolidin-1-yl]furo[3,2-c]pyridine.
What is the SMILES notation for 4-[(3S,4R)-3,4-difluoropyrrolidin-1-yl]furo[3,2-c]pyridine?
The canonical SMILES for 4-[(3S,4R)-3,4-difluoropyrrolidin-1-yl]furo[3,2-c]pyridine is F[C@@H]1CN(c2nccc3occc23)C[C@@H]1F.
What is the InChIKey of 4-[(3S,4R)-3,4-difluoropyrrolidin-1-yl]furo[3,2-c]pyridine?
The InChIKey is YSPHQDUGAQVXEV-DTORHVGOSA-N. The full InChI is InChI=1S/C11H10F2N2O/c12-8-5-15(6-9(8)13)11-7-2-4-16-10(7)1-3-14-11/h1-4,8-9H,5-6H2/t8-,9+.
What are the key properties of 4-[(3S,4R)-3,4-difluoropyrrolidin-1-yl]furo[3,2-c]pyridine?
4-[(3S,4R)-3,4-difluoropyrrolidin-1-yl]furo[3,2-c]pyridine has a molecular weight of 224.21 g/mol, XLogP of 2.32, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3S,4R)-3,4-difluoropyrrolidin-1-yl]furo[3,2-c]pyridine is sourced from PubChem (CID 138039104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).