N-[(2-fluorophenyl)methyl]spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-amine

C18H18FN — CID 164613508

IUPACN-[(2-fluorophenyl)methyl]spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-amine
SMILESFc1ccccc1CNC1CC12CCc1ccccc12
InChIInChI=1S/C18H18FN/c19-16-8-4-2-6-14(16)12-20-17-11-18(17)10-9-13-5-1-3-7-15(13)18/h1-8,17,20H,9-12H2
InChIKeyRAPIPJBUMYLYKZ-UHFFFAOYSA-N
MW267.35 g/mol
LogP3.57
Rot. Bonds3

About N-[(2-fluorophenyl)methyl]spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-amine

N-[(2-fluorophenyl)methyl]spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-amine (PubChem CID 164613508) has the molecular formula C18H18FN and a molecular weight of 267.35 g/mol. Its IUPAC name is N-[(2-fluorophenyl)methyl]spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-amine.

Molecular Properties

Compound NameN-[(2-fluorophenyl)methyl]spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-amine
PubChem CID164613508
Molecular FormulaC18H18FN
Molecular Weight267.35 g/mol
Exact Mass267.14
IUPAC NameN-[(2-fluorophenyl)methyl]spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-amine
SMILESFc1ccccc1CNC1CC12CCc1ccccc12
InChIInChI=1S/C18H18FN/c19-16-8-4-2-6-14(16)12-20-17-11-18(17)10-9-13-5-1-3-7-15(13)18/h1-8,17,20H,9-12H2
InChIKeyRAPIPJBUMYLYKZ-UHFFFAOYSA-N
XLogP3.57
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.35
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(9H-Fluoren-9-yl)piperazine
CID 410205
1-[3-(4-Fluoro-phenyl)-indan-1-yl]-piperazine
CID 14208318
Indan-2-yl-(3-phenyl-propyl)-amine
CID 15061890
N-(2-phenylethyl)-2,3-dihydro-1H-inden-2-amine
CID 21648335
Benzyl-(6,7,8,9-tetrahydro-5H-benzocyclohepten-7-yl)-amine
CID 22499189
(4aS,5R,9bS)-5-phenyl-2,3,4,4a,5,9b-hexahydro-1H-indeno[1,2-b]pyridine
CID 44358388
trans-(1S,2R)-N-benzyl-2-phenylcyclopropan-1-amine
CID 44572695
N-methyl-3-phenyl-indan-1-amine;hydrochloride
CID 45260274
N-(1-phenylethyl)-9H-fluoren-9-amine
CID 4782290
1H-Indeno(1,2-b)pyridine, 2,3,4,4a,5,9b-hexahydro-5-phenyl-, (4a-alpha,5-beta,9b-alpha)-
CID 38055
1H-Indeno(1,2-b)pyridine, 2,3,4,4a,5,9b-hexahydro-5-(2-fluorophenyl)-, (4a-alpha,5-beta,9b-alpha)-
CID 44358171
1H-Indeno(1,2-b)pyridine, 2,3,4,4a,5,9b-hexahydro-5-(4-fluorophenyl)-, (4a-alpha,5-beta,9b-alpha)-
CID 44358186

Frequently Asked Questions

What is the IUPAC name of N-[(2-fluorophenyl)methyl]spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-amine?
The IUPAC name of N-[(2-fluorophenyl)methyl]spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-amine (CID 164613508) is N-[(2-fluorophenyl)methyl]spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-amine.
What is the SMILES notation for N-[(2-fluorophenyl)methyl]spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-amine?
The canonical SMILES for N-[(2-fluorophenyl)methyl]spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-amine is Fc1ccccc1CNC1CC12CCc1ccccc12.
What is the InChIKey of N-[(2-fluorophenyl)methyl]spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-amine?
The InChIKey is RAPIPJBUMYLYKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18FN/c19-16-8-4-2-6-14(16)12-20-17-11-18(17)10-9-13-5-1-3-7-15(13)18/h1-8,17,20H,9-12H2.
What are the key properties of N-[(2-fluorophenyl)methyl]spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-amine?
N-[(2-fluorophenyl)methyl]spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-amine has a molecular weight of 267.35 g/mol, XLogP of 3.57, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-fluorophenyl)methyl]spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-amine is sourced from PubChem (CID 164613508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).