2-[1-(5-fluoro-2,3-dihydro-1H-inden-1-yl)piperidin-4-yl]ethanamine

C16H23FN2 — CID 116531465

IUPAC2-[1-(5-fluoro-2,3-dihydro-1H-inden-1-yl)piperidin-4-yl]ethanamine
SMILESNCCC1CCN(C2CCc3cc(F)ccc32)CC1
InChIInChI=1S/C16H23FN2/c17-14-2-3-15-13(11-14)1-4-16(15)19-9-6-12(5-8-18)7-10-19/h2-3,11-12,16H,1,4-10,18H2
InChIKeyXQNJQGYORXTQOL-UHFFFAOYSA-N
MW262.37 g/mol
LogP2.87
Rot. Bonds3

About 2-[1-(5-fluoro-2,3-dihydro-1H-inden-1-yl)piperidin-4-yl]ethanamine

2-[1-(5-fluoro-2,3-dihydro-1H-inden-1-yl)piperidin-4-yl]ethanamine (PubChem CID 116531465) has the molecular formula C16H23FN2 and a molecular weight of 262.37 g/mol. Its IUPAC name is 2-[1-(5-fluoro-2,3-dihydro-1H-inden-1-yl)piperidin-4-yl]ethanamine.

Molecular Properties

Compound Name2-[1-(5-fluoro-2,3-dihydro-1H-inden-1-yl)piperidin-4-yl]ethanamine
PubChem CID116531465
Molecular FormulaC16H23FN2
Molecular Weight262.37 g/mol
Exact Mass262.18
IUPAC Name2-[1-(5-fluoro-2,3-dihydro-1H-inden-1-yl)piperidin-4-yl]ethanamine
SMILESNCCC1CCN(C2CCc3cc(F)ccc32)CC1
InChIInChI=1S/C16H23FN2/c17-14-2-3-15-13(11-14)1-4-16(15)19-9-6-12(5-8-18)7-10-19/h2-3,11-12,16H,1,4-10,18H2
InChIKeyXQNJQGYORXTQOL-UHFFFAOYSA-N
XLogP2.87
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.37
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-propylpiperidin-1-yl)-2,3-dihydro-1H-inden-5-amine
CID 79741362
1-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-4-methylpiperidin-3-amine
CID 116531458
3-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-3,9-diazabicyclo[4.2.1]nonane
CID 116531514
2-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-3,4-dihydro-1H-isoquinolin-5-amine
CID 116531428
(10bS)-8-fluoro-1,2,3,5,6,10b-hexahydropyrrolo[2,1-a]isoquinolin-1-amine
CID 142337194
1-[4-[(dimethylamino)methyl]piperidin-1-yl]-2,3-dihydro-1H-inden-5-ol
CID 107684985
1-[5-[2-(3-fluorophenyl)ethynyl]-2,3-dihydro-1H-inden-1-yl]pyrrolidine
CID 167135969
5-fluoro-2,3-dihydro-1H-inden-1-amine
CID 16666328
(3S,4S)-1-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-4-methylpyrrolidine-3-carboxylic acid
CID 114086353
(9-iodo-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-yl)methanamine
CID 163575422
1-(6-fluoro-2,3-dihydroindol-1-yl)-2,3-dihydro-1H-inden-5-amine
CID 103504352
4-(2-aminoethyl)-N-(2,4-difluorophenyl)piperidine-1-carboxamide
CID 56773384

Frequently Asked Questions

What is the IUPAC name of 2-[1-(5-fluoro-2,3-dihydro-1H-inden-1-yl)piperidin-4-yl]ethanamine?
The IUPAC name of 2-[1-(5-fluoro-2,3-dihydro-1H-inden-1-yl)piperidin-4-yl]ethanamine (CID 116531465) is 2-[1-(5-fluoro-2,3-dihydro-1H-inden-1-yl)piperidin-4-yl]ethanamine.
What is the SMILES notation for 2-[1-(5-fluoro-2,3-dihydro-1H-inden-1-yl)piperidin-4-yl]ethanamine?
The canonical SMILES for 2-[1-(5-fluoro-2,3-dihydro-1H-inden-1-yl)piperidin-4-yl]ethanamine is NCCC1CCN(C2CCc3cc(F)ccc32)CC1.
What is the InChIKey of 2-[1-(5-fluoro-2,3-dihydro-1H-inden-1-yl)piperidin-4-yl]ethanamine?
The InChIKey is XQNJQGYORXTQOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23FN2/c17-14-2-3-15-13(11-14)1-4-16(15)19-9-6-12(5-8-18)7-10-19/h2-3,11-12,16H,1,4-10,18H2.
What are the key properties of 2-[1-(5-fluoro-2,3-dihydro-1H-inden-1-yl)piperidin-4-yl]ethanamine?
2-[1-(5-fluoro-2,3-dihydro-1H-inden-1-yl)piperidin-4-yl]ethanamine has a molecular weight of 262.37 g/mol, XLogP of 2.87, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(5-fluoro-2,3-dihydro-1H-inden-1-yl)piperidin-4-yl]ethanamine is sourced from PubChem (CID 116531465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).