N-ethyl-2,2,2-trifluoroethanamine

C4H8F3N — CID 12769779

IUPACN-ethyl-2,2,2-trifluoroethanamine
SMILESCCNCC(F)(F)F
InChIInChI=1S/C4H8F3N/c1-2-8-3-4(5,6)7/h8H,2-3H2,1H3
InChIKeyGFQKFGQPVBTZOV-UHFFFAOYSA-N
MW127.11 g/mol
LogP1.16
Rot. Bonds2

About N-ethyl-2,2,2-trifluoroethanamine

N-ethyl-2,2,2-trifluoroethanamine (PubChem CID 12769779) has the molecular formula C4H8F3N and a molecular weight of 127.11 g/mol. Its IUPAC name is N-ethyl-2,2,2-trifluoroethanamine.

Molecular Properties

Compound NameN-ethyl-2,2,2-trifluoroethanamine
PubChem CID12769779
Molecular FormulaC4H8F3N
Molecular Weight127.11 g/mol
Exact Mass127.06
IUPAC NameN-ethyl-2,2,2-trifluoroethanamine
SMILESCCNCC(F)(F)F
InChIInChI=1S/C4H8F3N/c1-2-8-3-4(5,6)7/h8H,2-3H2,1H3
InChIKeyGFQKFGQPVBTZOV-UHFFFAOYSA-N
XLogP1.16
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.11
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-ethyl-2,2-difluoro-2-iodoethanamine
CID 129161141
1-ethyl-2-(2,2,2-trifluoroethyl)hydrazine
CID 118974813
(2S)-3-(ethylamino)-1,1,1-trifluoro-2-methylpropan-2-ol
CID 146248092
N-ethyl-2-(2,2,2-trifluoroethylamino)acetamide
CID 28595910
N-ethyl-2,2-difluoro-2-methylsulfonylethanamine
CID 83108570
N-ethyl-2-methyl-2-(2,2,2-trifluoroethoxy)butan-1-amine
CID 62353424
2,2,2-trifluoro-N-[2-(2-methylbutan-2-yloxy)ethyl]ethanamine
CID 62597446
2-methyl-1-N-(2,2,2-trifluoroethyl)propane-1,2-diamine
CID 61264894
2-propyl-N-(2,2,2-trifluoroethyl)pentan-1-amine
CID 82983950
N-ethyl-2-methyl-2-(4,4,4-trifluorobutoxy)propan-1-amine
CID 82792763
N,N',2,2-tetraethyl-N'-(2,2,2-trifluoroethyl)propane-1,3-diamine
CID 62256557
1-(ethylamino)-2-methylpropane-2-thiol
CID 13049084

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2,2,2-trifluoroethanamine?
The IUPAC name of N-ethyl-2,2,2-trifluoroethanamine (CID 12769779) is N-ethyl-2,2,2-trifluoroethanamine.
What is the SMILES notation for N-ethyl-2,2,2-trifluoroethanamine?
The canonical SMILES for N-ethyl-2,2,2-trifluoroethanamine is CCNCC(F)(F)F.
What is the InChIKey of N-ethyl-2,2,2-trifluoroethanamine?
The InChIKey is GFQKFGQPVBTZOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8F3N/c1-2-8-3-4(5,6)7/h8H,2-3H2,1H3.
What are the key properties of N-ethyl-2,2,2-trifluoroethanamine?
N-ethyl-2,2,2-trifluoroethanamine has a molecular weight of 127.11 g/mol, XLogP of 1.16, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2,2,2-trifluoroethanamine is sourced from PubChem (CID 12769779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).