(2R)-1,1,1-trifluoro-2-thiophen-3-ylpropan-2-amine

C7H8F3NS — CID 131081620

IUPAC(2R)-1,1,1-trifluoro-2-thiophen-3-ylpropan-2-amine
SMILESC[C@@](N)(c1ccsc1)C(F)(F)F
InChIInChI=1S/C7H8F3NS/c1-6(11,7(8,9)10)5-2-3-12-4-5/h2-4H,11H2,1H3/t6-/m1/s1
InChIKeyDMZAFYMEBGCOLX-ZCFIWIBFSA-N
MW195.21 g/mol
LogP2.48
Rot. Bonds1

About (2R)-1,1,1-trifluoro-2-thiophen-3-ylpropan-2-amine

(2R)-1,1,1-trifluoro-2-thiophen-3-ylpropan-2-amine (PubChem CID 131081620) has the molecular formula C7H8F3NS and a molecular weight of 195.21 g/mol. Its IUPAC name is (2R)-1,1,1-trifluoro-2-thiophen-3-ylpropan-2-amine.

Molecular Properties

Compound Name(2R)-1,1,1-trifluoro-2-thiophen-3-ylpropan-2-amine
PubChem CID131081620
Molecular FormulaC7H8F3NS
Molecular Weight195.21 g/mol
Exact Mass195.03
IUPAC Name(2R)-1,1,1-trifluoro-2-thiophen-3-ylpropan-2-amine
SMILESC[C@@](N)(c1ccsc1)C(F)(F)F
InChIInChI=1S/C7H8F3NS/c1-6(11,7(8,9)10)5-2-3-12-4-5/h2-4H,11H2,1H3/t6-/m1/s1
InChIKeyDMZAFYMEBGCOLX-ZCFIWIBFSA-N
XLogP2.48
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.21
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(trifluoromethyl)thiophene
CID 2769441
2,3-dimethyl-3-thiophen-3-ylbutan-2-amine
CID 18719736
(2S)-1,1,1-trifluoro-2-phenylpropan-2-amine;hydrochloride
CID 67693696
ethane;2-thiophen-3-ylpropan-2-ol
CID 144659448
3-thiophen-3-ylpentan-3-amine
CID 65099925
1-(2-fluorophenyl)-1-thiophen-3-ylethanamine
CID 65099629
2-methyl-2-thiophen-3-ylbutan-1-amine
CID 82412624
1-phenyl-1-thiophen-3-ylpropan-1-amine
CID 65100038
1,1,1-trifluoro-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)propan-2-amine
CID 113461182
1-cyclopentyl-1-thiophen-3-ylethanamine
CID 171097776
4-amino-3,3-dimethyl-2-thiophen-3-ylbutan-2-ol
CID 127003873
1-(3,4-dimethylphenyl)-1-thiophen-3-ylethanamine
CID 65099237

Frequently Asked Questions

What is the IUPAC name of (2R)-1,1,1-trifluoro-2-thiophen-3-ylpropan-2-amine?
The IUPAC name of (2R)-1,1,1-trifluoro-2-thiophen-3-ylpropan-2-amine (CID 131081620) is (2R)-1,1,1-trifluoro-2-thiophen-3-ylpropan-2-amine.
What is the SMILES notation for (2R)-1,1,1-trifluoro-2-thiophen-3-ylpropan-2-amine?
The canonical SMILES for (2R)-1,1,1-trifluoro-2-thiophen-3-ylpropan-2-amine is C[C@@](N)(c1ccsc1)C(F)(F)F.
What is the InChIKey of (2R)-1,1,1-trifluoro-2-thiophen-3-ylpropan-2-amine?
The InChIKey is DMZAFYMEBGCOLX-ZCFIWIBFSA-N. The full InChI is InChI=1S/C7H8F3NS/c1-6(11,7(8,9)10)5-2-3-12-4-5/h2-4H,11H2,1H3/t6-/m1/s1.
What are the key properties of (2R)-1,1,1-trifluoro-2-thiophen-3-ylpropan-2-amine?
(2R)-1,1,1-trifluoro-2-thiophen-3-ylpropan-2-amine has a molecular weight of 195.21 g/mol, XLogP of 2.48, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1,1,1-trifluoro-2-thiophen-3-ylpropan-2-amine is sourced from PubChem (CID 131081620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).