2-ethyl-1-(2,2,2-trifluoroethoxymethyl)cyclopropan-1-amine

C8H14F3NO — CID 103476530

IUPAC2-ethyl-1-(2,2,2-trifluoroethoxymethyl)cyclopropan-1-amine
SMILESCCC1CC1(N)COCC(F)(F)F
InChIInChI=1S/C8H14F3NO/c1-2-6-3-7(6,12)4-13-5-8(9,10)11/h6H,2-5,12H2,1H3
InChIKeyZCVDTNOOHXEQFV-UHFFFAOYSA-N
MW197.20 g/mol
LogP1.69
Rot. Bonds4

About 2-ethyl-1-(2,2,2-trifluoroethoxymethyl)cyclopropan-1-amine

2-ethyl-1-(2,2,2-trifluoroethoxymethyl)cyclopropan-1-amine (PubChem CID 103476530) has the molecular formula C8H14F3NO and a molecular weight of 197.20 g/mol. Its IUPAC name is 2-ethyl-1-(2,2,2-trifluoroethoxymethyl)cyclopropan-1-amine.

Molecular Properties

Compound Name2-ethyl-1-(2,2,2-trifluoroethoxymethyl)cyclopropan-1-amine
PubChem CID103476530
Molecular FormulaC8H14F3NO
Molecular Weight197.20 g/mol
Exact Mass197.10
IUPAC Name2-ethyl-1-(2,2,2-trifluoroethoxymethyl)cyclopropan-1-amine
SMILESCCC1CC1(N)COCC(F)(F)F
InChIInChI=1S/C8H14F3NO/c1-2-6-3-7(6,12)4-13-5-8(9,10)11/h6H,2-5,12H2,1H3
InChIKeyZCVDTNOOHXEQFV-UHFFFAOYSA-N
XLogP1.69
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.20
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-1-(2,2,2-trifluoroethoxymethyl)cyclopropan-1-amine?
The IUPAC name of 2-ethyl-1-(2,2,2-trifluoroethoxymethyl)cyclopropan-1-amine (CID 103476530) is 2-ethyl-1-(2,2,2-trifluoroethoxymethyl)cyclopropan-1-amine.
What is the SMILES notation for 2-ethyl-1-(2,2,2-trifluoroethoxymethyl)cyclopropan-1-amine?
The canonical SMILES for 2-ethyl-1-(2,2,2-trifluoroethoxymethyl)cyclopropan-1-amine is CCC1CC1(N)COCC(F)(F)F.
What is the InChIKey of 2-ethyl-1-(2,2,2-trifluoroethoxymethyl)cyclopropan-1-amine?
The InChIKey is ZCVDTNOOHXEQFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14F3NO/c1-2-6-3-7(6,12)4-13-5-8(9,10)11/h6H,2-5,12H2,1H3.
What are the key properties of 2-ethyl-1-(2,2,2-trifluoroethoxymethyl)cyclopropan-1-amine?
2-ethyl-1-(2,2,2-trifluoroethoxymethyl)cyclopropan-1-amine has a molecular weight of 197.20 g/mol, XLogP of 1.69, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-1-(2,2,2-trifluoroethoxymethyl)cyclopropan-1-amine is sourced from PubChem (CID 103476530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).