N-(2,2,2-trifluoroethyl)-2,3-dihydro-1H-inden-1-amine

C11H12F3N — CID 24702173

IUPACN-(2,2,2-trifluoroethyl)-2,3-dihydro-1H-inden-1-amine
SMILESFC(F)(F)CNC1CCc2ccccc21
InChIInChI=1S/C11H12F3N/c12-11(13,14)7-15-10-6-5-8-3-1-2-4-9(8)10/h1-4,10,15H,5-7H2
InChIKeyKNVOFGLUJUVDNY-UHFFFAOYSA-N
MW215.22 g/mol
LogP2.83
Rot. Bonds2

About N-(2,2,2-trifluoroethyl)-2,3-dihydro-1H-inden-1-amine

N-(2,2,2-trifluoroethyl)-2,3-dihydro-1H-inden-1-amine (PubChem CID 24702173) has the molecular formula C11H12F3N and a molecular weight of 215.22 g/mol. Its IUPAC name is N-(2,2,2-trifluoroethyl)-2,3-dihydro-1H-inden-1-amine.

Molecular Properties

Compound NameN-(2,2,2-trifluoroethyl)-2,3-dihydro-1H-inden-1-amine
PubChem CID24702173
Molecular FormulaC11H12F3N
Molecular Weight215.22 g/mol
Exact Mass215.09
IUPAC NameN-(2,2,2-trifluoroethyl)-2,3-dihydro-1H-inden-1-amine
SMILESFC(F)(F)CNC1CCc2ccccc21
InChIInChI=1S/C11H12F3N/c12-11(13,14)7-15-10-6-5-8-3-1-2-4-9(8)10/h1-4,10,15H,5-7H2
InChIKeyKNVOFGLUJUVDNY-UHFFFAOYSA-N
XLogP2.83
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.22
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2,3-dihydro-1H-inden-1-ylamino)-N-(2,2,2-trifluoroethyl)acetamide
CID 60702700
3-[[(1R)-2,3-dihydro-1H-inden-1-yl]amino]-2,2-difluoropropane-1-sulfonic acid
CID 58691898
3-[[(1R)-2,3-dihydro-1H-inden-1-yl]amino]-2,2-difluoropropane-1-sulfinic acid
CID 58691871
3-[[(1S)-2,3-dihydro-1H-inden-1-yl]amino]-2,2-difluoropropane-1-sulfonic acid
CID 58691972
N-(2,3-dihydro-1H-inden-1-yl)-2-(2,2,2-trifluoroethylamino)acetamide
CID 78932004
methyl 3-(2,3-dihydro-1H-inden-1-ylamino)-2-hydroxy-2-methylpropanoate
CID 113436484
N-[[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]methyl]-2,3-dihydro-1H-inden-1-amine
CID 126785604
2,2,2-trifluoro-N-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenylmethyl)ethanamine
CID 83985097
N-(cyclopentylmethyl)-2,3-dihydro-1H-inden-1-amine
CID 43370878
2-[[(1S)-2,3-dihydro-1H-inden-1-yl]amino]acetic acid
CID 13100819
N-[(2,6-difluorophenyl)methyl]-2,3-dihydro-1H-inden-1-amine
CID 43181872
2-[[(1S)-2,3-dihydro-1H-inden-1-yl]amino]acetic acid;hydrochloride
CID 22976313

Frequently Asked Questions

What is the IUPAC name of N-(2,2,2-trifluoroethyl)-2,3-dihydro-1H-inden-1-amine?
The IUPAC name of N-(2,2,2-trifluoroethyl)-2,3-dihydro-1H-inden-1-amine (CID 24702173) is N-(2,2,2-trifluoroethyl)-2,3-dihydro-1H-inden-1-amine.
What is the SMILES notation for N-(2,2,2-trifluoroethyl)-2,3-dihydro-1H-inden-1-amine?
The canonical SMILES for N-(2,2,2-trifluoroethyl)-2,3-dihydro-1H-inden-1-amine is FC(F)(F)CNC1CCc2ccccc21.
What is the InChIKey of N-(2,2,2-trifluoroethyl)-2,3-dihydro-1H-inden-1-amine?
The InChIKey is KNVOFGLUJUVDNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12F3N/c12-11(13,14)7-15-10-6-5-8-3-1-2-4-9(8)10/h1-4,10,15H,5-7H2.
What are the key properties of N-(2,2,2-trifluoroethyl)-2,3-dihydro-1H-inden-1-amine?
N-(2,2,2-trifluoroethyl)-2,3-dihydro-1H-inden-1-amine has a molecular weight of 215.22 g/mol, XLogP of 2.83, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2,2-trifluoroethyl)-2,3-dihydro-1H-inden-1-amine is sourced from PubChem (CID 24702173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).