(1R)-3,3,3-trifluoro-1-(furan-3-yl)propan-1-amine;hydrochloride

C7H9ClF3NO — CID 171212335

IUPAC(1R)-3,3,3-trifluoro-1-(furan-3-yl)propan-1-amine;hydrochloride
SMILESCl.N[C@H](CC(F)(F)F)c1ccoc1
InChIInChI=1S/C7H8F3NO.ClH/c8-7(9,10)3-6(11)5-1-2-12-4-5;/h1-2,4,6H,3,11H2;1H/t6-;/m1./s1
InChIKeyVDCROUGDQBIFHB-FYZOBXCZSA-N
MW215.60 g/mol
LogP2.65
Rot. Bonds2

About (1R)-3,3,3-trifluoro-1-(furan-3-yl)propan-1-amine;hydrochloride

(1R)-3,3,3-trifluoro-1-(furan-3-yl)propan-1-amine;hydrochloride (PubChem CID 171212335) has the molecular formula C7H9ClF3NO and a molecular weight of 215.60 g/mol. Its IUPAC name is (1R)-3,3,3-trifluoro-1-(furan-3-yl)propan-1-amine;hydrochloride.

Molecular Properties

Compound Name(1R)-3,3,3-trifluoro-1-(furan-3-yl)propan-1-amine;hydrochloride
PubChem CID171212335
Molecular FormulaC7H9ClF3NO
Molecular Weight215.60 g/mol
Exact Mass215.03
IUPAC Name(1R)-3,3,3-trifluoro-1-(furan-3-yl)propan-1-amine;hydrochloride
SMILESCl.N[C@H](CC(F)(F)F)c1ccoc1
InChIInChI=1S/C7H8F3NO.ClH/c8-7(9,10)3-6(11)5-1-2-12-4-5;/h1-2,4,6H,3,11H2;1H/t6-;/m1./s1
InChIKeyVDCROUGDQBIFHB-FYZOBXCZSA-N
XLogP2.65
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.60
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 171231940
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CID 171212353
(1R)-3-fluoro-1-(furan-3-yl)propan-1-amine
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CID 115894673
(1R)-1-(furan-3-yl)butane-1,4-diamine;hydrochloride
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(1R)-1-(furan-3-yl)-4-methylpentan-1-amine;hydrochloride
CID 171212351
(1S)-1-(furan-3-yl)butan-1-amine
CID 78960978
furan-3-ylmethanediamine
CID 54545098
1-(furan-3-yl)-2-methoxyethanamine
CID 63948777
1-(furan-3-yl)-2-[(2-methylpropan-2-yl)oxy]ethanamine
CID 105146670
4-[(1S)-1-amino-3,3,3-trifluoropropyl]-N,N-diethylaniline;hydrochloride
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4,4,4-trifluoro-1-(furan-3-yl)butan-1-ol
CID 64567375

Frequently Asked Questions

What is the IUPAC name of (1R)-3,3,3-trifluoro-1-(furan-3-yl)propan-1-amine;hydrochloride?
The IUPAC name of (1R)-3,3,3-trifluoro-1-(furan-3-yl)propan-1-amine;hydrochloride (CID 171212335) is (1R)-3,3,3-trifluoro-1-(furan-3-yl)propan-1-amine;hydrochloride.
What is the SMILES notation for (1R)-3,3,3-trifluoro-1-(furan-3-yl)propan-1-amine;hydrochloride?
The canonical SMILES for (1R)-3,3,3-trifluoro-1-(furan-3-yl)propan-1-amine;hydrochloride is Cl.N[C@H](CC(F)(F)F)c1ccoc1.
What is the InChIKey of (1R)-3,3,3-trifluoro-1-(furan-3-yl)propan-1-amine;hydrochloride?
The InChIKey is VDCROUGDQBIFHB-FYZOBXCZSA-N. The full InChI is InChI=1S/C7H8F3NO.ClH/c8-7(9,10)3-6(11)5-1-2-12-4-5;/h1-2,4,6H,3,11H2;1H/t6-;/m1./s1.
What are the key properties of (1R)-3,3,3-trifluoro-1-(furan-3-yl)propan-1-amine;hydrochloride?
(1R)-3,3,3-trifluoro-1-(furan-3-yl)propan-1-amine;hydrochloride has a molecular weight of 215.60 g/mol, XLogP of 2.65, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-3,3,3-trifluoro-1-(furan-3-yl)propan-1-amine;hydrochloride is sourced from PubChem (CID 171212335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).