5-fluorospiro[2H-1-benzofuran-3,3'-pyrrolidine]

C11H12FNO — CID 130901339

IUPAC5-fluorospiro[2H-1-benzofuran-3,3'-pyrrolidine]
SMILESFc1ccc2c(c1)C1(CCNC1)CO2
InChIInChI=1S/C11H12FNO/c12-8-1-2-10-9(5-8)11(7-14-10)3-4-13-6-11/h1-2,5,13H,3-4,6-7H2
InChIKeyASZFYCDTYZUAJP-UHFFFAOYSA-N
MW193.22 g/mol
LogP1.45
Rot. Bonds

About 5-fluorospiro[2H-1-benzofuran-3,3'-pyrrolidine]

5-fluorospiro[2H-1-benzofuran-3,3'-pyrrolidine] (PubChem CID 130901339) has the molecular formula C11H12FNO and a molecular weight of 193.22 g/mol. Its IUPAC name is 5-fluorospiro[2H-1-benzofuran-3,3'-pyrrolidine].

Molecular Properties

Compound Name5-fluorospiro[2H-1-benzofuran-3,3'-pyrrolidine]
PubChem CID130901339
Molecular FormulaC11H12FNO
Molecular Weight193.22 g/mol
Exact Mass193.09
IUPAC Name5-fluorospiro[2H-1-benzofuran-3,3'-pyrrolidine]
SMILESFc1ccc2c(c1)C1(CCNC1)CO2
InChIInChI=1S/C11H12FNO/c12-8-1-2-10-9(5-8)11(7-14-10)3-4-13-6-11/h1-2,5,13H,3-4,6-7H2
InChIKeyASZFYCDTYZUAJP-UHFFFAOYSA-N
XLogP1.45
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.22
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

CID 59528212
CID 59528212
spiro[2H-1-benzofuran-3,4'-piperidine]-5-carbonitrile
CID 70984337
6-bromospiro[2,3-dihydrochromene-4,3'-pyrrolidine]
CID 82625302
spiro[2H-1-benzofuran-3,3'-piperidine];hydrochloride
CID 146155745
6-fluorospiro[3H-1,4-benzodioxine-2,3'-piperidine]
CID 117045993
1'-[(1R,2S,4R)-2-bicyclo[2.2.1]heptanyl]-5-fluorospiro[2H-1-benzofuran-3,4'-piperidine]
CID 59433857
spiro[2,3-dihydrochromene-4,3'-pyrrolidine]
CID 59233929
6-fluorospiro[2H-chromene-3,1'-cyclopropane]-4-one
CID 82277921
5-fluorospiro[3H-1-benzofuran-2,4'-piperidine];hydrochloride
CID 68958919
CID 58295805
CID 58295805
5-fluorospiro[1H-indole-3,3'-pyrrolidine]-2-one
CID 83820003
7-bromospiro[2,3-dihydrochromene-4,3'-pyrrolidine]
CID 82625303

Frequently Asked Questions

What is the IUPAC name of 5-fluorospiro[2H-1-benzofuran-3,3'-pyrrolidine]?
The IUPAC name of 5-fluorospiro[2H-1-benzofuran-3,3'-pyrrolidine] (CID 130901339) is 5-fluorospiro[2H-1-benzofuran-3,3'-pyrrolidine].
What is the SMILES notation for 5-fluorospiro[2H-1-benzofuran-3,3'-pyrrolidine]?
The canonical SMILES for 5-fluorospiro[2H-1-benzofuran-3,3'-pyrrolidine] is Fc1ccc2c(c1)C1(CCNC1)CO2.
What is the InChIKey of 5-fluorospiro[2H-1-benzofuran-3,3'-pyrrolidine]?
The InChIKey is ASZFYCDTYZUAJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12FNO/c12-8-1-2-10-9(5-8)11(7-14-10)3-4-13-6-11/h1-2,5,13H,3-4,6-7H2.
What are the key properties of 5-fluorospiro[2H-1-benzofuran-3,3'-pyrrolidine]?
5-fluorospiro[2H-1-benzofuran-3,3'-pyrrolidine] has a molecular weight of 193.22 g/mol, XLogP of 1.45, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluorospiro[2H-1-benzofuran-3,3'-pyrrolidine] is sourced from PubChem (CID 130901339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).