(E)-4,4,4-trifluoro-N,N-dimethylbut-2-en-2-amine

C6H10F3N — CID 129271803

IUPAC(E)-4,4,4-trifluoro-N,N-dimethylbut-2-en-2-amine
SMILESC/C(=C\C(F)(F)F)N(C)C
InChIInChI=1S/C6H10F3N/c1-5(10(2)3)4-6(7,8)9/h4H,1-3H3/b5-4+
InChIKeyAYJUMTDRXAJMBI-SNAWJCMRSA-N
MW153.15 g/mol
LogP2.01
Rot. Bonds1

About (E)-4,4,4-trifluoro-N,N-dimethylbut-2-en-2-amine

(E)-4,4,4-trifluoro-N,N-dimethylbut-2-en-2-amine (PubChem CID 129271803) has the molecular formula C6H10F3N and a molecular weight of 153.15 g/mol. Its IUPAC name is (E)-4,4,4-trifluoro-N,N-dimethylbut-2-en-2-amine.

Molecular Properties

Compound Name(E)-4,4,4-trifluoro-N,N-dimethylbut-2-en-2-amine
PubChem CID129271803
Molecular FormulaC6H10F3N
Molecular Weight153.15 g/mol
Exact Mass153.08
IUPAC Name(E)-4,4,4-trifluoro-N,N-dimethylbut-2-en-2-amine
SMILESC/C(=C\C(F)(F)F)N(C)C
InChIInChI=1S/C6H10F3N/c1-5(10(2)3)4-6(7,8)9/h4H,1-3H3/b5-4+
InChIKeyAYJUMTDRXAJMBI-SNAWJCMRSA-N
XLogP2.01
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.15
LogP ≤ 52.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

Ethene, 1-(dimethylamino)-1-(trifluoromethyl)-
CID 586956
(E)-N,N-dimethylbut-2-en-2-amine
CID 6916002
N-methyl-N-(3,3,3-trifluoroprop-1-en-2-yl)penta-2,4-dien-2-amine
CID 123892342
(2Z)-1,1,1-trifluoro-N,N-dimethylpenta-2,4-dien-2-amine
CID 139385369
(E)-1-fluoro-N-methyl-N-prop-1-en-2-ylprop-1-en-1-amine
CID 146392901
(Z)-N-(1-fluoroethyl)-N-methylbut-2-en-2-amine
CID 167142859
(Z)-N-methyl-N-(2,2,2-trifluoroethyl)but-2-en-2-amine
CID 167287848
(Z)-N-propan-2-yl-N-(trifluoromethyl)but-2-en-2-amine
CID 170040571
N-methyl-N-(2,2,2-trifluoroethyl)but-2-en-2-amine
CID 174100546
2-Buten-2-amine, 1,1,1,4,4,4-hexafluoro-N,N-dimethyl-
CID 5463142
(E)-N,N-bis(trifluoromethyl)but-2-en-2-amine
CID 21732199
(Z)-N,N-bis(trifluoromethyl)but-2-en-2-amine
CID 21732200

Frequently Asked Questions

What is the IUPAC name of (E)-4,4,4-trifluoro-N,N-dimethylbut-2-en-2-amine?
The IUPAC name of (E)-4,4,4-trifluoro-N,N-dimethylbut-2-en-2-amine (CID 129271803) is (E)-4,4,4-trifluoro-N,N-dimethylbut-2-en-2-amine.
What is the SMILES notation for (E)-4,4,4-trifluoro-N,N-dimethylbut-2-en-2-amine?
The canonical SMILES for (E)-4,4,4-trifluoro-N,N-dimethylbut-2-en-2-amine is C/C(=C\C(F)(F)F)N(C)C.
What is the InChIKey of (E)-4,4,4-trifluoro-N,N-dimethylbut-2-en-2-amine?
The InChIKey is AYJUMTDRXAJMBI-SNAWJCMRSA-N. The full InChI is InChI=1S/C6H10F3N/c1-5(10(2)3)4-6(7,8)9/h4H,1-3H3/b5-4+.
What are the key properties of (E)-4,4,4-trifluoro-N,N-dimethylbut-2-en-2-amine?
(E)-4,4,4-trifluoro-N,N-dimethylbut-2-en-2-amine has a molecular weight of 153.15 g/mol, XLogP of 2.01, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-4,4,4-trifluoro-N,N-dimethylbut-2-en-2-amine is sourced from PubChem (CID 129271803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).