5-fluoro-N-(2-methyl-2-phenylpropyl)-2,3-dihydro-1H-inden-1-amine

C19H22FN — CID 116530970

IUPAC5-fluoro-N-(2-methyl-2-phenylpropyl)-2,3-dihydro-1H-inden-1-amine
SMILESCC(C)(CNC1CCc2cc(F)ccc21)c1ccccc1
InChIInChI=1S/C19H22FN/c1-19(2,15-6-4-3-5-7-15)13-21-18-11-8-14-12-16(20)9-10-17(14)18/h3-7,9-10,12,18,21H,8,11,13H2,1-2H3
InChIKeyZHGZLDWKICHCLA-UHFFFAOYSA-N
MW283.39 g/mol
LogP4.38
Rot. Bonds4

About 5-fluoro-N-(2-methyl-2-phenylpropyl)-2,3-dihydro-1H-inden-1-amine

5-fluoro-N-(2-methyl-2-phenylpropyl)-2,3-dihydro-1H-inden-1-amine (PubChem CID 116530970) has the molecular formula C19H22FN and a molecular weight of 283.39 g/mol. Its IUPAC name is 5-fluoro-N-(2-methyl-2-phenylpropyl)-2,3-dihydro-1H-inden-1-amine.

Molecular Properties

Compound Name5-fluoro-N-(2-methyl-2-phenylpropyl)-2,3-dihydro-1H-inden-1-amine
PubChem CID116530970
Molecular FormulaC19H22FN
Molecular Weight283.39 g/mol
Exact Mass283.17
IUPAC Name5-fluoro-N-(2-methyl-2-phenylpropyl)-2,3-dihydro-1H-inden-1-amine
SMILESCC(C)(CNC1CCc2cc(F)ccc21)c1ccccc1
InChIInChI=1S/C19H22FN/c1-19(2,15-6-4-3-5-7-15)13-21-18-11-8-14-12-16(20)9-10-17(14)18/h3-7,9-10,12,18,21H,8,11,13H2,1-2H3
InChIKeyZHGZLDWKICHCLA-UHFFFAOYSA-N
XLogP4.38
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.39
LogP ≤ 54.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5-fluoro-N-(2-methyl-2-phenylpropyl)-2,3-dihydro-1H-inden-1-amine?
The IUPAC name of 5-fluoro-N-(2-methyl-2-phenylpropyl)-2,3-dihydro-1H-inden-1-amine (CID 116530970) is 5-fluoro-N-(2-methyl-2-phenylpropyl)-2,3-dihydro-1H-inden-1-amine.
What is the SMILES notation for 5-fluoro-N-(2-methyl-2-phenylpropyl)-2,3-dihydro-1H-inden-1-amine?
The canonical SMILES for 5-fluoro-N-(2-methyl-2-phenylpropyl)-2,3-dihydro-1H-inden-1-amine is CC(C)(CNC1CCc2cc(F)ccc21)c1ccccc1.
What is the InChIKey of 5-fluoro-N-(2-methyl-2-phenylpropyl)-2,3-dihydro-1H-inden-1-amine?
The InChIKey is ZHGZLDWKICHCLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22FN/c1-19(2,15-6-4-3-5-7-15)13-21-18-11-8-14-12-16(20)9-10-17(14)18/h3-7,9-10,12,18,21H,8,11,13H2,1-2H3.
What are the key properties of 5-fluoro-N-(2-methyl-2-phenylpropyl)-2,3-dihydro-1H-inden-1-amine?
5-fluoro-N-(2-methyl-2-phenylpropyl)-2,3-dihydro-1H-inden-1-amine has a molecular weight of 283.39 g/mol, XLogP of 4.38, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-N-(2-methyl-2-phenylpropyl)-2,3-dihydro-1H-inden-1-amine is sourced from PubChem (CID 116530970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).