(Z)-3,3,3-trifluoro-1-prop-1-en-2-ylsulfanylprop-1-en-2-amine

C6H8F3NS — CID 162556629

IUPAC(Z)-3,3,3-trifluoro-1-prop-1-en-2-ylsulfanylprop-1-en-2-amine
SMILESC=C(C)S/C=C(\N)C(F)(F)F
InChIInChI=1S/C6H8F3NS/c1-4(2)11-3-5(10)6(7,8)9/h3H,1,10H2,2H3/b5-3-
InChIKeyYXDXFJJKURIAMI-HYXAFXHYSA-N
MW183.20 g/mol
LogP2.62
Rot. Bonds2

About (Z)-3,3,3-trifluoro-1-prop-1-en-2-ylsulfanylprop-1-en-2-amine

(Z)-3,3,3-trifluoro-1-prop-1-en-2-ylsulfanylprop-1-en-2-amine (PubChem CID 162556629) has the molecular formula C6H8F3NS and a molecular weight of 183.20 g/mol. Its IUPAC name is (Z)-3,3,3-trifluoro-1-prop-1-en-2-ylsulfanylprop-1-en-2-amine.

Molecular Properties

Compound Name(Z)-3,3,3-trifluoro-1-prop-1-en-2-ylsulfanylprop-1-en-2-amine
PubChem CID162556629
Molecular FormulaC6H8F3NS
Molecular Weight183.20 g/mol
Exact Mass183.03
IUPAC Name(Z)-3,3,3-trifluoro-1-prop-1-en-2-ylsulfanylprop-1-en-2-amine
SMILESC=C(C)S/C=C(\N)C(F)(F)F
InChIInChI=1S/C6H8F3NS/c1-4(2)11-3-5(10)6(7,8)9/h3H,1,10H2,2H3/b5-3-
InChIKeyYXDXFJJKURIAMI-HYXAFXHYSA-N
XLogP2.62
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.20
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (Z)-3,3,3-trifluoro-1-prop-1-en-2-ylsulfanylprop-1-en-2-amine?
The IUPAC name of (Z)-3,3,3-trifluoro-1-prop-1-en-2-ylsulfanylprop-1-en-2-amine (CID 162556629) is (Z)-3,3,3-trifluoro-1-prop-1-en-2-ylsulfanylprop-1-en-2-amine.
What is the SMILES notation for (Z)-3,3,3-trifluoro-1-prop-1-en-2-ylsulfanylprop-1-en-2-amine?
The canonical SMILES for (Z)-3,3,3-trifluoro-1-prop-1-en-2-ylsulfanylprop-1-en-2-amine is C=C(C)S/C=C(\N)C(F)(F)F.
What is the InChIKey of (Z)-3,3,3-trifluoro-1-prop-1-en-2-ylsulfanylprop-1-en-2-amine?
The InChIKey is YXDXFJJKURIAMI-HYXAFXHYSA-N. The full InChI is InChI=1S/C6H8F3NS/c1-4(2)11-3-5(10)6(7,8)9/h3H,1,10H2,2H3/b5-3-.
What are the key properties of (Z)-3,3,3-trifluoro-1-prop-1-en-2-ylsulfanylprop-1-en-2-amine?
(Z)-3,3,3-trifluoro-1-prop-1-en-2-ylsulfanylprop-1-en-2-amine has a molecular weight of 183.20 g/mol, XLogP of 2.62, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3,3,3-trifluoro-1-prop-1-en-2-ylsulfanylprop-1-en-2-amine is sourced from PubChem (CID 162556629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).