2-propyl-1-[2-(2,2,2-trifluoroethoxy)ethyl]cyclopropan-1-amine

C10H18F3NO — CID 103150691

IUPAC2-propyl-1-[2-(2,2,2-trifluoroethoxy)ethyl]cyclopropan-1-amine
SMILESCCCC1CC1(N)CCOCC(F)(F)F
InChIInChI=1S/C10H18F3NO/c1-2-3-8-6-9(8,14)4-5-15-7-10(11,12)13/h8H,2-7,14H2,1H3
InChIKeyDPWJKPDAARDZMB-UHFFFAOYSA-N
MW225.25 g/mol
LogP2.47
Rot. Bonds6

About 2-propyl-1-[2-(2,2,2-trifluoroethoxy)ethyl]cyclopropan-1-amine

2-propyl-1-[2-(2,2,2-trifluoroethoxy)ethyl]cyclopropan-1-amine (PubChem CID 103150691) has the molecular formula C10H18F3NO and a molecular weight of 225.25 g/mol. Its IUPAC name is 2-propyl-1-[2-(2,2,2-trifluoroethoxy)ethyl]cyclopropan-1-amine.

Molecular Properties

Compound Name2-propyl-1-[2-(2,2,2-trifluoroethoxy)ethyl]cyclopropan-1-amine
PubChem CID103150691
Molecular FormulaC10H18F3NO
Molecular Weight225.25 g/mol
Exact Mass225.13
IUPAC Name2-propyl-1-[2-(2,2,2-trifluoroethoxy)ethyl]cyclopropan-1-amine
SMILESCCCC1CC1(N)CCOCC(F)(F)F
InChIInChI=1S/C10H18F3NO/c1-2-3-8-6-9(8,14)4-5-15-7-10(11,12)13/h8H,2-7,14H2,1H3
InChIKeyDPWJKPDAARDZMB-UHFFFAOYSA-N
XLogP2.47
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.25
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 2-propyl-1-[2-(2,2,2-trifluoroethoxy)ethyl]cyclopropan-1-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 2-propyl-1-[2-(2,2,2-trifluoroethoxy)ethyl]cyclopropan-1-amine?
The IUPAC name of 2-propyl-1-[2-(2,2,2-trifluoroethoxy)ethyl]cyclopropan-1-amine (CID 103150691) is 2-propyl-1-[2-(2,2,2-trifluoroethoxy)ethyl]cyclopropan-1-amine.
What is the SMILES notation for 2-propyl-1-[2-(2,2,2-trifluoroethoxy)ethyl]cyclopropan-1-amine?
The canonical SMILES for 2-propyl-1-[2-(2,2,2-trifluoroethoxy)ethyl]cyclopropan-1-amine is CCCC1CC1(N)CCOCC(F)(F)F.
What is the InChIKey of 2-propyl-1-[2-(2,2,2-trifluoroethoxy)ethyl]cyclopropan-1-amine?
The InChIKey is DPWJKPDAARDZMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18F3NO/c1-2-3-8-6-9(8,14)4-5-15-7-10(11,12)13/h8H,2-7,14H2,1H3.
What are the key properties of 2-propyl-1-[2-(2,2,2-trifluoroethoxy)ethyl]cyclopropan-1-amine?
2-propyl-1-[2-(2,2,2-trifluoroethoxy)ethyl]cyclopropan-1-amine has a molecular weight of 225.25 g/mol, XLogP of 2.47, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propyl-1-[2-(2,2,2-trifluoroethoxy)ethyl]cyclopropan-1-amine is sourced from PubChem (CID 103150691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).