[2-(2,3-dihydroindol-1-yl)-5-fluorophenyl]methanamine

C15H15FN2 — CID 43313804

IUPAC[2-(2,3-dihydroindol-1-yl)-5-fluorophenyl]methanamine
SMILESNCc1cc(F)ccc1N1CCc2ccccc21
InChIInChI=1S/C15H15FN2/c16-13-5-6-15(12(9-13)10-17)18-8-7-11-3-1-2-4-14(11)18/h1-6,9H,7-8,10,17H2
InChIKeyYKGJGKQHVAUJKZ-UHFFFAOYSA-N
MW242.30 g/mol
LogP2.98
Rot. Bonds2

About [2-(2,3-dihydroindol-1-yl)-5-fluorophenyl]methanamine

[2-(2,3-dihydroindol-1-yl)-5-fluorophenyl]methanamine (PubChem CID 43313804) has the molecular formula C15H15FN2 and a molecular weight of 242.30 g/mol. Its IUPAC name is [2-(2,3-dihydroindol-1-yl)-5-fluorophenyl]methanamine.

Molecular Properties

Compound Name[2-(2,3-dihydroindol-1-yl)-5-fluorophenyl]methanamine
PubChem CID43313804
Molecular FormulaC15H15FN2
Molecular Weight242.30 g/mol
Exact Mass242.12
IUPAC Name[2-(2,3-dihydroindol-1-yl)-5-fluorophenyl]methanamine
SMILESNCc1cc(F)ccc1N1CCc2ccccc21
InChIInChI=1S/C15H15FN2/c16-13-5-6-15(12(9-13)10-17)18-8-7-11-3-1-2-4-14(11)18/h1-6,9H,7-8,10,17H2
InChIKeyYKGJGKQHVAUJKZ-UHFFFAOYSA-N
XLogP2.98
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.30
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [2-(2,3-dihydroindol-1-yl)-5-fluorophenyl]methanamine?
The IUPAC name of [2-(2,3-dihydroindol-1-yl)-5-fluorophenyl]methanamine (CID 43313804) is [2-(2,3-dihydroindol-1-yl)-5-fluorophenyl]methanamine.
What is the SMILES notation for [2-(2,3-dihydroindol-1-yl)-5-fluorophenyl]methanamine?
The canonical SMILES for [2-(2,3-dihydroindol-1-yl)-5-fluorophenyl]methanamine is NCc1cc(F)ccc1N1CCc2ccccc21.
What is the InChIKey of [2-(2,3-dihydroindol-1-yl)-5-fluorophenyl]methanamine?
The InChIKey is YKGJGKQHVAUJKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15FN2/c16-13-5-6-15(12(9-13)10-17)18-8-7-11-3-1-2-4-14(11)18/h1-6,9H,7-8,10,17H2.
What are the key properties of [2-(2,3-dihydroindol-1-yl)-5-fluorophenyl]methanamine?
[2-(2,3-dihydroindol-1-yl)-5-fluorophenyl]methanamine has a molecular weight of 242.30 g/mol, XLogP of 2.98, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2,3-dihydroindol-1-yl)-5-fluorophenyl]methanamine is sourced from PubChem (CID 43313804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).