2-(6-fluoro-3H-inden-1-yl)-2-methylpropan-1-amine

C13H16FN — CID 105457773

IUPAC2-(6-fluoro-3H-inden-1-yl)-2-methylpropan-1-amine
SMILESCC(C)(CN)C1=CCc2ccc(F)cc21
InChIInChI=1S/C13H16FN/c1-13(2,8-15)12-6-4-9-3-5-10(14)7-11(9)12/h3,5-7H,4,8,15H2,1-2H3
InChIKeyKAXXQAQMJMOQPM-UHFFFAOYSA-N
MW205.28 g/mol
LogP2.75
Rot. Bonds2

About 2-(6-fluoro-3H-inden-1-yl)-2-methylpropan-1-amine

2-(6-fluoro-3H-inden-1-yl)-2-methylpropan-1-amine (PubChem CID 105457773) has the molecular formula C13H16FN and a molecular weight of 205.28 g/mol. Its IUPAC name is 2-(6-fluoro-3H-inden-1-yl)-2-methylpropan-1-amine.

Molecular Properties

Compound Name2-(6-fluoro-3H-inden-1-yl)-2-methylpropan-1-amine
PubChem CID105457773
Molecular FormulaC13H16FN
Molecular Weight205.28 g/mol
Exact Mass205.13
IUPAC Name2-(6-fluoro-3H-inden-1-yl)-2-methylpropan-1-amine
SMILESCC(C)(CN)C1=CCc2ccc(F)cc21
InChIInChI=1S/C13H16FN/c1-13(2,8-15)12-6-4-9-3-5-10(14)7-11(9)12/h3,5-7H,4,8,15H2,1-2H3
InChIKeyKAXXQAQMJMOQPM-UHFFFAOYSA-N
XLogP2.75
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.28
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(3H-inden-1-yl)-2-methylpropan-1-amine
CID 105442824
cobalt;5-fluoro-3-propyl-1H-indene
CID 58657549
CID 89263528
CID 89263528
(6-fluoro-3H-inden-1-yl) butanoate
CID 174543457
2-tert-butyl-6-fluoro-3H-isoindol-1-one
CID 165464085
2-(5-fluoro-1-benzofuran-2-yl)-2-methylpropan-1-amine
CID 114735425
(6-fluoro-1-methyl-2,3-dihydroinden-1-yl)methanamine
CID 84718266
methyl (2S,5S)-6-(6-fluoro-3H-inden-1-yl)-2,5-dimethylhexanoate
CID 158601352
4-fluorobicyclo[4.2.0]octa-1(6),2,4-trien-7-one
CID 10975535
2-methyl-2-(2,4,6-trifluorophenyl)propan-1-amine
CID 83412673
[(7S)-4-fluoro-7-bicyclo[4.2.0]octa-1(6),2,4-trienyl]methanamine
CID 98041428
N'-[(2,4-difluorophenyl)methyl]-N',2,2-trimethylpropane-1,3-diamine
CID 79645329

Frequently Asked Questions

What is the IUPAC name of 2-(6-fluoro-3H-inden-1-yl)-2-methylpropan-1-amine?
The IUPAC name of 2-(6-fluoro-3H-inden-1-yl)-2-methylpropan-1-amine (CID 105457773) is 2-(6-fluoro-3H-inden-1-yl)-2-methylpropan-1-amine.
What is the SMILES notation for 2-(6-fluoro-3H-inden-1-yl)-2-methylpropan-1-amine?
The canonical SMILES for 2-(6-fluoro-3H-inden-1-yl)-2-methylpropan-1-amine is CC(C)(CN)C1=CCc2ccc(F)cc21.
What is the InChIKey of 2-(6-fluoro-3H-inden-1-yl)-2-methylpropan-1-amine?
The InChIKey is KAXXQAQMJMOQPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16FN/c1-13(2,8-15)12-6-4-9-3-5-10(14)7-11(9)12/h3,5-7H,4,8,15H2,1-2H3.
What are the key properties of 2-(6-fluoro-3H-inden-1-yl)-2-methylpropan-1-amine?
2-(6-fluoro-3H-inden-1-yl)-2-methylpropan-1-amine has a molecular weight of 205.28 g/mol, XLogP of 2.75, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-fluoro-3H-inden-1-yl)-2-methylpropan-1-amine is sourced from PubChem (CID 105457773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).