3-[[propyl(2,2,2-trifluoroethyl)amino]methyl]oxolan-3-amine

C10H19F3N2O — CID 64891238

IUPAC3-[[propyl(2,2,2-trifluoroethyl)amino]methyl]oxolan-3-amine
SMILESCCCN(CC(F)(F)F)CC1(N)CCOC1
InChIInChI=1S/C10H19F3N2O/c1-2-4-15(7-10(11,12)13)6-9(14)3-5-16-8-9/h2-8,14H2,1H3
InChIKeyJQHGFQZEIAFBPV-UHFFFAOYSA-N
MW240.27 g/mol
LogP1.38
Rot. Bonds5

About 3-[[propyl(2,2,2-trifluoroethyl)amino]methyl]oxolan-3-amine

3-[[propyl(2,2,2-trifluoroethyl)amino]methyl]oxolan-3-amine (PubChem CID 64891238) has the molecular formula C10H19F3N2O and a molecular weight of 240.27 g/mol. Its IUPAC name is 3-[[propyl(2,2,2-trifluoroethyl)amino]methyl]oxolan-3-amine.

Molecular Properties

Compound Name3-[[propyl(2,2,2-trifluoroethyl)amino]methyl]oxolan-3-amine
PubChem CID64891238
Molecular FormulaC10H19F3N2O
Molecular Weight240.27 g/mol
Exact Mass240.14
IUPAC Name3-[[propyl(2,2,2-trifluoroethyl)amino]methyl]oxolan-3-amine
SMILESCCCN(CC(F)(F)F)CC1(N)CCOC1
InChIInChI=1S/C10H19F3N2O/c1-2-4-15(7-10(11,12)13)6-9(14)3-5-16-8-9/h2-8,14H2,1H3
InChIKeyJQHGFQZEIAFBPV-UHFFFAOYSA-N
XLogP1.38
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.27
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-[[propyl(2,2,2-trifluoroethyl)amino]methyl]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 3-[[propyl(2,2,2-trifluoroethyl)amino]methyl]oxolan-3-amine?
The IUPAC name of 3-[[propyl(2,2,2-trifluoroethyl)amino]methyl]oxolan-3-amine (CID 64891238) is 3-[[propyl(2,2,2-trifluoroethyl)amino]methyl]oxolan-3-amine.
What is the SMILES notation for 3-[[propyl(2,2,2-trifluoroethyl)amino]methyl]oxolan-3-amine?
The canonical SMILES for 3-[[propyl(2,2,2-trifluoroethyl)amino]methyl]oxolan-3-amine is CCCN(CC(F)(F)F)CC1(N)CCOC1.
What is the InChIKey of 3-[[propyl(2,2,2-trifluoroethyl)amino]methyl]oxolan-3-amine?
The InChIKey is JQHGFQZEIAFBPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19F3N2O/c1-2-4-15(7-10(11,12)13)6-9(14)3-5-16-8-9/h2-8,14H2,1H3.
What are the key properties of 3-[[propyl(2,2,2-trifluoroethyl)amino]methyl]oxolan-3-amine?
3-[[propyl(2,2,2-trifluoroethyl)amino]methyl]oxolan-3-amine has a molecular weight of 240.27 g/mol, XLogP of 1.38, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[propyl(2,2,2-trifluoroethyl)amino]methyl]oxolan-3-amine is sourced from PubChem (CID 64891238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).