(5-fluorospiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-yl)methanamine

C12H14FN — CID 105445172

IUPAC(5-fluorospiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-yl)methanamine
SMILESNCC1CC12CCc1ccc(F)cc12
InChIInChI=1S/C12H14FN/c13-10-2-1-8-3-4-12(11(8)5-10)6-9(12)7-14/h1-2,5,9H,3-4,6-7,14H2
InChIKeyBVICAXXOARQQFX-UHFFFAOYSA-N
MW191.25 g/mol
LogP1.99
Rot. Bonds1

About (5-fluorospiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-yl)methanamine

(5-fluorospiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-yl)methanamine (PubChem CID 105445172) has the molecular formula C12H14FN and a molecular weight of 191.25 g/mol. Its IUPAC name is (5-fluorospiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-yl)methanamine.

Molecular Properties

Compound Name(5-fluorospiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-yl)methanamine
PubChem CID105445172
Molecular FormulaC12H14FN
Molecular Weight191.25 g/mol
Exact Mass191.11
IUPAC Name(5-fluorospiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-yl)methanamine
SMILESNCC1CC12CCc1ccc(F)cc12
InChIInChI=1S/C12H14FN/c13-10-2-1-8-3-4-12(11(8)5-10)6-9(12)7-14/h1-2,5,9H,3-4,6-7,14H2
InChIKeyBVICAXXOARQQFX-UHFFFAOYSA-N
XLogP1.99
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.25
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

[(1'S,3R)-spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-yl]methanamine
CID 94557979
(6-methoxyspiro[2,3-dihydro-1H-naphthalene-4,2'-cyclopropane]-1'-yl)methanamine
CID 79247847
(6-fluorospiro[3,4-dihydro-2H-naphthalene-1,1'-cyclohexane]-2-yl)methanamine
CID 115057321
(6-fluoro-1-methyl-2,3-dihydroinden-1-yl)methanamine
CID 84718266
6-fluorospiro[2,3-dihydrothiochromene-4,2'-cyclopropane]-1'-amine
CID 105463194
2-[1-(aminomethyl)cyclopentyl]-4-fluoroaniline
CID 117047242
(4bR,8aS)-4b-(2-aminoethyl)-3-fluoro-5,6,7,8,9,10-hexahydrophenanthren-8a-ol;hydrochloride
CID 139682529
2'-(bromomethyl)-5-methoxyspiro[1,2-dihydroindene-3,1'-cyclopropane]
CID 81351637
(6-fluoro-2,3-dihydro-1H-inden-1-yl)methanamine
CID 82074741
1-bromo-6-fluoro-2,3-dihydroinden-1-ol
CID 174726827
5-fluorospiro[1,2-dihydroisoindole-3,1'-cyclopropane]
CID 115012818
6-fluorospiro[2,3-dihydro-1H-quinoline-4,2'-cyclopropane]-1'-amine
CID 105446089

Frequently Asked Questions

What is the IUPAC name of (5-fluorospiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-yl)methanamine?
The IUPAC name of (5-fluorospiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-yl)methanamine (CID 105445172) is (5-fluorospiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-yl)methanamine.
What is the SMILES notation for (5-fluorospiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-yl)methanamine?
The canonical SMILES for (5-fluorospiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-yl)methanamine is NCC1CC12CCc1ccc(F)cc12.
What is the InChIKey of (5-fluorospiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-yl)methanamine?
The InChIKey is BVICAXXOARQQFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14FN/c13-10-2-1-8-3-4-12(11(8)5-10)6-9(12)7-14/h1-2,5,9H,3-4,6-7,14H2.
What are the key properties of (5-fluorospiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-yl)methanamine?
(5-fluorospiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-yl)methanamine has a molecular weight of 191.25 g/mol, XLogP of 1.99, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5-fluorospiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-yl)methanamine is sourced from PubChem (CID 105445172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).