5-fluorospiro[1,2-dihydroisoindole-3,1'-cyclopropane]

C10H10FN — CID 115012818

IUPAC5-fluorospiro[1,2-dihydroisoindole-3,1'-cyclopropane]
SMILESFc1ccc2c(c1)C1(CC1)NC2
InChIInChI=1S/C10H10FN/c11-8-2-1-7-6-12-10(3-4-10)9(7)5-8/h1-2,5,12H,3-4,6H2
InChIKeyNEZYYUVBFWWFHW-UHFFFAOYSA-N
MW163.19 g/mol
LogP1.92
Rot. Bonds

About 5-fluorospiro[1,2-dihydroisoindole-3,1'-cyclopropane]

5-fluorospiro[1,2-dihydroisoindole-3,1'-cyclopropane] (PubChem CID 115012818) has the molecular formula C10H10FN and a molecular weight of 163.19 g/mol. Its IUPAC name is 5-fluorospiro[1,2-dihydroisoindole-3,1'-cyclopropane].

Molecular Properties

Compound Name5-fluorospiro[1,2-dihydroisoindole-3,1'-cyclopropane]
PubChem CID115012818
Molecular FormulaC10H10FN
Molecular Weight163.19 g/mol
Exact Mass163.08
IUPAC Name5-fluorospiro[1,2-dihydroisoindole-3,1'-cyclopropane]
SMILESFc1ccc2c(c1)C1(CC1)NC2
InChIInChI=1S/C10H10FN/c11-8-2-1-7-6-12-10(3-4-10)9(7)5-8/h1-2,5,12H,3-4,6H2
InChIKeyNEZYYUVBFWWFHW-UHFFFAOYSA-N
XLogP1.92
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.19
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

6-methylspiro[1,2-dihydroisoindole-3,1'-cyclopropane]
CID 115012486
7-fluoro-5,5-dimethyl-1,2,3,4-tetrahydro-2-benzazepine
CID 84720142
(3S)-6-fluorospiro[1,2-dihydroindene-3,2'-pyrrolidine]
CID 86327550
5,6-dimethoxyspiro[1,2-dihydroisoindole-3,1'-cyclopropane]
CID 105457553
6,7-difluorospiro[3,4-dihydro-2H-isoquinoline-1,1'-cyclopropane]
CID 117273958
(5-fluorospiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-yl)methanamine
CID 105445172
1-bromo-6-fluoro-2,3-dihydroinden-1-ol
CID 174726827
(1S)-7-fluoro-1-methyl-3,4-dihydro-2H-isoquinolin-1-ol
CID 155312725
6-methylspiro[1,2-dihydroisoindole-3,4'-piperidine]
CID 84721497
6-fluoro-1-hydroxy-2,3-dihydroindene-1-carbaldehyde
CID 105438538
4-fluoro-1-methyl-2-(1-methylcyclohexyl)benzene
CID 123739587
6-fluoro-5'-methylspiro[1,2-dihydroindene-3,2'-1,3-thiazolidine]
CID 116532160

Frequently Asked Questions

What is the IUPAC name of 5-fluorospiro[1,2-dihydroisoindole-3,1'-cyclopropane]?
The IUPAC name of 5-fluorospiro[1,2-dihydroisoindole-3,1'-cyclopropane] (CID 115012818) is 5-fluorospiro[1,2-dihydroisoindole-3,1'-cyclopropane].
What is the SMILES notation for 5-fluorospiro[1,2-dihydroisoindole-3,1'-cyclopropane]?
The canonical SMILES for 5-fluorospiro[1,2-dihydroisoindole-3,1'-cyclopropane] is Fc1ccc2c(c1)C1(CC1)NC2.
What is the InChIKey of 5-fluorospiro[1,2-dihydroisoindole-3,1'-cyclopropane]?
The InChIKey is NEZYYUVBFWWFHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10FN/c11-8-2-1-7-6-12-10(3-4-10)9(7)5-8/h1-2,5,12H,3-4,6H2.
What are the key properties of 5-fluorospiro[1,2-dihydroisoindole-3,1'-cyclopropane]?
5-fluorospiro[1,2-dihydroisoindole-3,1'-cyclopropane] has a molecular weight of 163.19 g/mol, XLogP of 1.92, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluorospiro[1,2-dihydroisoindole-3,1'-cyclopropane] is sourced from PubChem (CID 115012818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).