3,3,3-trifluoro-N,N-dimethylprop-1-en-2-amine

C5H8F3N — CID 586956

IUPAC3,3,3-trifluoro-N,N-dimethylprop-1-en-2-amine
SMILESC=C(N(C)C)C(F)(F)F
InChIInChI=1S/C5H8F3N/c1-4(9(2)3)5(6,7)8/h1H2,2-3H3
InChIKeyWNTUIPZBNDWZTK-UHFFFAOYSA-N
MW139.12 g/mol
LogP1.62
Rot. Bonds1

About 3,3,3-trifluoro-N,N-dimethylprop-1-en-2-amine

3,3,3-trifluoro-N,N-dimethylprop-1-en-2-amine (PubChem CID 586956) has the molecular formula C5H8F3N and a molecular weight of 139.12 g/mol. Its IUPAC name is 3,3,3-trifluoro-N,N-dimethylprop-1-en-2-amine.

Molecular Properties

Compound Name3,3,3-trifluoro-N,N-dimethylprop-1-en-2-amine
PubChem CID586956
Molecular FormulaC5H8F3N
Molecular Weight139.12 g/mol
Exact Mass139.06
IUPAC Name3,3,3-trifluoro-N,N-dimethylprop-1-en-2-amine
SMILESC=C(N(C)C)C(F)(F)F
InChIInChI=1S/C5H8F3N/c1-4(9(2)3)5(6,7)8/h1H2,2-3H3
InChIKeyWNTUIPZBNDWZTK-UHFFFAOYSA-N
XLogP1.62
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.12
LogP ≤ 51.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

Ethene, 1-(diethylamino)-1-(trifluoromethyl)-
CID 592255
3,3-difluoro-N,N-dimethylbut-1-en-2-amine
CID 89662729
3-bromo-3,3-difluoro-N,N-dimethylprop-1-en-2-amine
CID 117812942
(E)-4,4,4-trifluoro-N,N-dimethylbut-2-en-2-amine
CID 129271803
(Z)-1,3,3,3-tetrafluoro-N-methyl-N-(trifluoromethyl)prop-1-en-2-amine
CID 130418375
(Z)-1,3,3,3-tetrafluoro-N,N-dimethylprop-1-en-2-amine
CID 130427149
1,1-difluoro-N,N-dimethylprop-1-en-2-amine
CID 134530504
3,3,3-trifluoro-N-iodo-N-methylprop-1-en-2-amine
CID 134534151
1,1-difluoro-N-methyl-N-(trifluoromethyl)prop-1-en-2-amine
CID 134534166
(Z)-N,1,3,3,3-pentafluoro-N-methylprop-1-en-2-amine
CID 137474646
N-(2-fluoroethyl)-N-(fluoromethyl)prop-1-en-2-amine
CID 146292682
(E)-1-fluoro-N-methyl-N-prop-1-en-2-ylprop-1-en-1-amine
CID 146392901

Frequently Asked Questions

What is the IUPAC name of 3,3,3-trifluoro-N,N-dimethylprop-1-en-2-amine?
The IUPAC name of 3,3,3-trifluoro-N,N-dimethylprop-1-en-2-amine (CID 586956) is 3,3,3-trifluoro-N,N-dimethylprop-1-en-2-amine.
What is the SMILES notation for 3,3,3-trifluoro-N,N-dimethylprop-1-en-2-amine?
The canonical SMILES for 3,3,3-trifluoro-N,N-dimethylprop-1-en-2-amine is C=C(N(C)C)C(F)(F)F.
What is the InChIKey of 3,3,3-trifluoro-N,N-dimethylprop-1-en-2-amine?
The InChIKey is WNTUIPZBNDWZTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8F3N/c1-4(9(2)3)5(6,7)8/h1H2,2-3H3.
What are the key properties of 3,3,3-trifluoro-N,N-dimethylprop-1-en-2-amine?
3,3,3-trifluoro-N,N-dimethylprop-1-en-2-amine has a molecular weight of 139.12 g/mol, XLogP of 1.62, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3,3-trifluoro-N,N-dimethylprop-1-en-2-amine is sourced from PubChem (CID 586956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).