cis-(1R,3S)-3-ethyl-N-(2,2,2-trifluoroethyl)cyclopentan-1-amine

C9H16F3N — CID 70643219

IUPACcis-(1R,3S)-3-ethyl-N-(2,2,2-trifluoroethyl)cyclopentan-1-amine
SMILESCC[C@H]1CC[C@@H](NCC(F)(F)F)C1
InChIInChI=1S/C9H16F3N/c1-2-7-3-4-8(5-7)13-6-9(10,11)12/h7-8,13H,2-6H2,1H3/t7-,8+/m0/s1
InChIKeyFPCUAOOBVRJZPJ-JGVFFNPUSA-N
MW195.23 g/mol
LogP2.72
Rot. Bonds3

About cis-(1R,3S)-3-ethyl-N-(2,2,2-trifluoroethyl)cyclopentan-1-amine

cis-(1R,3S)-3-ethyl-N-(2,2,2-trifluoroethyl)cyclopentan-1-amine (PubChem CID 70643219) has the molecular formula C9H16F3N and a molecular weight of 195.23 g/mol. Its IUPAC name is cis-(1R,3S)-3-ethyl-N-(2,2,2-trifluoroethyl)cyclopentan-1-amine.

Molecular Properties

Compound Namecis-(1R,3S)-3-ethyl-N-(2,2,2-trifluoroethyl)cyclopentan-1-amine
PubChem CID70643219
Molecular FormulaC9H16F3N
Molecular Weight195.23 g/mol
Exact Mass195.12
IUPAC Namecis-(1R,3S)-3-ethyl-N-(2,2,2-trifluoroethyl)cyclopentan-1-amine
SMILESCC[C@H]1CC[C@@H](NCC(F)(F)F)C1
InChIInChI=1S/C9H16F3N/c1-2-7-3-4-8(5-7)13-6-9(10,11)12/h7-8,13H,2-6H2,1H3/t7-,8+/m0/s1
InChIKeyFPCUAOOBVRJZPJ-JGVFFNPUSA-N
XLogP2.72
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.23
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze cis-(1R,3S)-3-ethyl-N-(2,2,2-trifluoroethyl)cyclopentan-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 cis-(1R,3S)-3-ethyl-N-(2,2,2-trifluoroethyl)cyclopentan-1-amine?
The IUPAC name of cis-(1R,3S)-3-ethyl-N-(2,2,2-trifluoroethyl)cyclopentan-1-amine (CID 70643219) is cis-(1R,3S)-3-ethyl-N-(2,2,2-trifluoroethyl)cyclopentan-1-amine.
What is the SMILES notation for cis-(1R,3S)-3-ethyl-N-(2,2,2-trifluoroethyl)cyclopentan-1-amine?
The canonical SMILES for cis-(1R,3S)-3-ethyl-N-(2,2,2-trifluoroethyl)cyclopentan-1-amine is CC[C@H]1CC[C@@H](NCC(F)(F)F)C1.
What is the InChIKey of cis-(1R,3S)-3-ethyl-N-(2,2,2-trifluoroethyl)cyclopentan-1-amine?
The InChIKey is FPCUAOOBVRJZPJ-JGVFFNPUSA-N. The full InChI is InChI=1S/C9H16F3N/c1-2-7-3-4-8(5-7)13-6-9(10,11)12/h7-8,13H,2-6H2,1H3/t7-,8+/m0/s1.
What are the key properties of cis-(1R,3S)-3-ethyl-N-(2,2,2-trifluoroethyl)cyclopentan-1-amine?
cis-(1R,3S)-3-ethyl-N-(2,2,2-trifluoroethyl)cyclopentan-1-amine has a molecular weight of 195.23 g/mol, XLogP of 2.72, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1R,3S)-3-ethyl-N-(2,2,2-trifluoroethyl)cyclopentan-1-amine is sourced from PubChem (CID 70643219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).