2-(1-aminocyclopentyl)-N-(3-ethoxypropyl)-N-(2,2,2-trifluoroethyl)acetamide

C14H25F3N2O2 — CID 64684297

IUPAC2-(1-aminocyclopentyl)-N-(3-ethoxypropyl)-N-(2,2,2-trifluoroethyl)acetamide
SMILESCCOCCCN(CC(F)(F)F)C(=O)CC1(N)CCCC1
InChIInChI=1S/C14H25F3N2O2/c1-2-21-9-5-8-19(11-14(15,16)17)12(20)10-13(18)6-3-4-7-13/h2-11,18H2,1H3
InChIKeyJRNRMCQSSXWGMZ-UHFFFAOYSA-N
MW310.36 g/mol
LogP2.47
Rot. Bonds8

About 2-(1-aminocyclopentyl)-N-(3-ethoxypropyl)-N-(2,2,2-trifluoroethyl)acetamide

2-(1-aminocyclopentyl)-N-(3-ethoxypropyl)-N-(2,2,2-trifluoroethyl)acetamide (PubChem CID 64684297) has the molecular formula C14H25F3N2O2 and a molecular weight of 310.36 g/mol. Its IUPAC name is 2-(1-aminocyclopentyl)-N-(3-ethoxypropyl)-N-(2,2,2-trifluoroethyl)acetamide.

Molecular Properties

Compound Name2-(1-aminocyclopentyl)-N-(3-ethoxypropyl)-N-(2,2,2-trifluoroethyl)acetamide
PubChem CID64684297
Molecular FormulaC14H25F3N2O2
Molecular Weight310.36 g/mol
Exact Mass310.19
IUPAC Name2-(1-aminocyclopentyl)-N-(3-ethoxypropyl)-N-(2,2,2-trifluoroethyl)acetamide
SMILESCCOCCCN(CC(F)(F)F)C(=O)CC1(N)CCCC1
InChIInChI=1S/C14H25F3N2O2/c1-2-21-9-5-8-19(11-14(15,16)17)12(20)10-13(18)6-3-4-7-13/h2-11,18H2,1H3
InChIKeyJRNRMCQSSXWGMZ-UHFFFAOYSA-N
XLogP2.47
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.36
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-(1-aminocyclopentyl)-N-(3-ethoxypropyl)-N-(2,2,2-trifluoroethyl)acetamide 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-(1-aminocyclopentyl)-N-(3-ethoxypropyl)-N-(2,2,2-trifluoroethyl)acetamide?
The IUPAC name of 2-(1-aminocyclopentyl)-N-(3-ethoxypropyl)-N-(2,2,2-trifluoroethyl)acetamide (CID 64684297) is 2-(1-aminocyclopentyl)-N-(3-ethoxypropyl)-N-(2,2,2-trifluoroethyl)acetamide.
What is the SMILES notation for 2-(1-aminocyclopentyl)-N-(3-ethoxypropyl)-N-(2,2,2-trifluoroethyl)acetamide?
The canonical SMILES for 2-(1-aminocyclopentyl)-N-(3-ethoxypropyl)-N-(2,2,2-trifluoroethyl)acetamide is CCOCCCN(CC(F)(F)F)C(=O)CC1(N)CCCC1.
What is the InChIKey of 2-(1-aminocyclopentyl)-N-(3-ethoxypropyl)-N-(2,2,2-trifluoroethyl)acetamide?
The InChIKey is JRNRMCQSSXWGMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25F3N2O2/c1-2-21-9-5-8-19(11-14(15,16)17)12(20)10-13(18)6-3-4-7-13/h2-11,18H2,1H3.
What are the key properties of 2-(1-aminocyclopentyl)-N-(3-ethoxypropyl)-N-(2,2,2-trifluoroethyl)acetamide?
2-(1-aminocyclopentyl)-N-(3-ethoxypropyl)-N-(2,2,2-trifluoroethyl)acetamide has a molecular weight of 310.36 g/mol, XLogP of 2.47, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-aminocyclopentyl)-N-(3-ethoxypropyl)-N-(2,2,2-trifluoroethyl)acetamide is sourced from PubChem (CID 64684297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).