N-ethyl-2-methyl-3-(trifluoromethyl)oxolan-3-amine

C8H14F3NO — CID 82718035

IUPACN-ethyl-2-methyl-3-(trifluoromethyl)oxolan-3-amine
SMILESCCNC1(C(F)(F)F)CCOC1C
InChIInChI=1S/C8H14F3NO/c1-3-12-7(8(9,10)11)4-5-13-6(7)2/h6,12H,3-5H2,1-2H3
InChIKeyGOADPUAYCLMHHQ-UHFFFAOYSA-N
MW197.20 g/mol
LogP1.71
Rot. Bonds2

About N-ethyl-2-methyl-3-(trifluoromethyl)oxolan-3-amine

N-ethyl-2-methyl-3-(trifluoromethyl)oxolan-3-amine (PubChem CID 82718035) has the molecular formula C8H14F3NO and a molecular weight of 197.20 g/mol. Its IUPAC name is N-ethyl-2-methyl-3-(trifluoromethyl)oxolan-3-amine.

Molecular Properties

Compound NameN-ethyl-2-methyl-3-(trifluoromethyl)oxolan-3-amine
PubChem CID82718035
Molecular FormulaC8H14F3NO
Molecular Weight197.20 g/mol
Exact Mass197.10
IUPAC NameN-ethyl-2-methyl-3-(trifluoromethyl)oxolan-3-amine
SMILESCCNC1(C(F)(F)F)CCOC1C
InChIInChI=1S/C8H14F3NO/c1-3-12-7(8(9,10)11)4-5-13-6(7)2/h6,12H,3-5H2,1-2H3
InChIKeyGOADPUAYCLMHHQ-UHFFFAOYSA-N
XLogP1.71
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.20
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-ethyl-2-methyl-3-(trifluoromethyl)oxolan-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-methyl-3-(trifluoromethyl)oxolan-3-amine?
The IUPAC name of N-ethyl-2-methyl-3-(trifluoromethyl)oxolan-3-amine (CID 82718035) is N-ethyl-2-methyl-3-(trifluoromethyl)oxolan-3-amine.
What is the SMILES notation for N-ethyl-2-methyl-3-(trifluoromethyl)oxolan-3-amine?
The canonical SMILES for N-ethyl-2-methyl-3-(trifluoromethyl)oxolan-3-amine is CCNC1(C(F)(F)F)CCOC1C.
What is the InChIKey of N-ethyl-2-methyl-3-(trifluoromethyl)oxolan-3-amine?
The InChIKey is GOADPUAYCLMHHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14F3NO/c1-3-12-7(8(9,10)11)4-5-13-6(7)2/h6,12H,3-5H2,1-2H3.
What are the key properties of N-ethyl-2-methyl-3-(trifluoromethyl)oxolan-3-amine?
N-ethyl-2-methyl-3-(trifluoromethyl)oxolan-3-amine has a molecular weight of 197.20 g/mol, XLogP of 1.71, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-methyl-3-(trifluoromethyl)oxolan-3-amine is sourced from PubChem (CID 82718035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).