N-cyclopropyl-N-ethyl-2-[2-(2,2,2-trifluoroethoxy)ethylamino]acetamide

C11H19F3N2O2 — CID 55259535

IUPACN-cyclopropyl-N-ethyl-2-[2-(2,2,2-trifluoroethoxy)ethylamino]acetamide
SMILESCCN(C(=O)CNCCOCC(F)(F)F)C1CC1
InChIInChI=1S/C11H19F3N2O2/c1-2-16(9-3-4-9)10(17)7-15-5-6-18-8-11(12,13)14/h9,15H,2-8H2,1H3
InChIKeyZKDINUMDXMOCTB-UHFFFAOYSA-N
MW268.28 g/mol
LogP1.17
Rot. Bonds8

About N-cyclopropyl-N-ethyl-2-[2-(2,2,2-trifluoroethoxy)ethylamino]acetamide

N-cyclopropyl-N-ethyl-2-[2-(2,2,2-trifluoroethoxy)ethylamino]acetamide (PubChem CID 55259535) has the molecular formula C11H19F3N2O2 and a molecular weight of 268.28 g/mol. Its IUPAC name is N-cyclopropyl-N-ethyl-2-[2-(2,2,2-trifluoroethoxy)ethylamino]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-N-ethyl-2-[2-(2,2,2-trifluoroethoxy)ethylamino]acetamide
PubChem CID55259535
Molecular FormulaC11H19F3N2O2
Molecular Weight268.28 g/mol
Exact Mass268.14
IUPAC NameN-cyclopropyl-N-ethyl-2-[2-(2,2,2-trifluoroethoxy)ethylamino]acetamide
SMILESCCN(C(=O)CNCCOCC(F)(F)F)C1CC1
InChIInChI=1S/C11H19F3N2O2/c1-2-16(9-3-4-9)10(17)7-15-5-6-18-8-11(12,13)14/h9,15H,2-8H2,1H3
InChIKeyZKDINUMDXMOCTB-UHFFFAOYSA-N
XLogP1.17
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.28
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-ethyl-2-[2-(2,2,2-trifluoroethoxy)ethylamino]acetamide?
The IUPAC name of N-cyclopropyl-N-ethyl-2-[2-(2,2,2-trifluoroethoxy)ethylamino]acetamide (CID 55259535) is N-cyclopropyl-N-ethyl-2-[2-(2,2,2-trifluoroethoxy)ethylamino]acetamide.
What is the SMILES notation for N-cyclopropyl-N-ethyl-2-[2-(2,2,2-trifluoroethoxy)ethylamino]acetamide?
The canonical SMILES for N-cyclopropyl-N-ethyl-2-[2-(2,2,2-trifluoroethoxy)ethylamino]acetamide is CCN(C(=O)CNCCOCC(F)(F)F)C1CC1.
What is the InChIKey of N-cyclopropyl-N-ethyl-2-[2-(2,2,2-trifluoroethoxy)ethylamino]acetamide?
The InChIKey is ZKDINUMDXMOCTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19F3N2O2/c1-2-16(9-3-4-9)10(17)7-15-5-6-18-8-11(12,13)14/h9,15H,2-8H2,1H3.
What are the key properties of N-cyclopropyl-N-ethyl-2-[2-(2,2,2-trifluoroethoxy)ethylamino]acetamide?
N-cyclopropyl-N-ethyl-2-[2-(2,2,2-trifluoroethoxy)ethylamino]acetamide has a molecular weight of 268.28 g/mol, XLogP of 1.17, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-ethyl-2-[2-(2,2,2-trifluoroethoxy)ethylamino]acetamide is sourced from PubChem (CID 55259535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).