2,2,2-trifluoro-N-[2-(2-hydroxyethylamino)ethyl]acetamide

C6H11F3N2O2 — CID 87995133

IUPAC2,2,2-trifluoro-N-[2-(2-hydroxyethylamino)ethyl]acetamide
SMILESO=C(NCCNCCO)C(F)(F)F
InChIInChI=1S/C6H11F3N2O2/c7-6(8,9)5(13)11-2-1-10-3-4-12/h10,12H,1-4H2,(H,11,13)
InChIKeyAZWPFBJNQRPPDJ-UHFFFAOYSA-N
MW200.16 g/mol
LogP-0.75
Rot. Bonds5

About 2,2,2-trifluoro-N-[2-(2-hydroxyethylamino)ethyl]acetamide

2,2,2-trifluoro-N-[2-(2-hydroxyethylamino)ethyl]acetamide (PubChem CID 87995133) has the molecular formula C6H11F3N2O2 and a molecular weight of 200.16 g/mol. Its IUPAC name is 2,2,2-trifluoro-N-[2-(2-hydroxyethylamino)ethyl]acetamide.

Molecular Properties

Compound Name2,2,2-trifluoro-N-[2-(2-hydroxyethylamino)ethyl]acetamide
PubChem CID87995133
Molecular FormulaC6H11F3N2O2
Molecular Weight200.16 g/mol
Exact Mass200.08
IUPAC Name2,2,2-trifluoro-N-[2-(2-hydroxyethylamino)ethyl]acetamide
SMILESO=C(NCCNCCO)C(F)(F)F
InChIInChI=1S/C6H11F3N2O2/c7-6(8,9)5(13)11-2-1-10-3-4-12/h10,12H,1-4H2,(H,11,13)
InChIKeyAZWPFBJNQRPPDJ-UHFFFAOYSA-N
XLogP-0.75
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.16
LogP ≤ 5-0.75
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N,N'-Bis(2-hydroxyethyl)oxamide
CID 74638
N-(2-hydroxyethyl)-2-[(2-hydroxyethyl)amino]acetamide
CID 53940579
N-Trifluoroacetyl-2-aminoethanol
CID 95211
2-amino-N-(2-hydroxyethyl)acetamide
CID 14036758
N-(2-aminoethyl)-2-hydroxyacetamide hydrochloride
CID 88548145
N-(2-aminoethyl)-2-hydroxyacetamide
CID 13028016
N-[2-(2-hydroxyethylamino)ethyl]acetamide
CID 222310
N-(2-hydroxyethyl)oxalamide
CID 5249043
N-hydroxyethylaminoethyl oxamide
CID 87156919
N-[(2S)-2-amino-3-hydroxypropyl]-2,2,2-trifluoroacetamide
CID 10631392
N-acetyl-N-(2-trifluoroacetylaminoethyl)-(2'-hydroxyethyl)amine
CID 21187761
N-(3-amino-2-hydroxypropyl)-2,2,2-trifluoroacetamide
CID 23170382

Frequently Asked Questions

What is the IUPAC name of 2,2,2-trifluoro-N-[2-(2-hydroxyethylamino)ethyl]acetamide?
The IUPAC name of 2,2,2-trifluoro-N-[2-(2-hydroxyethylamino)ethyl]acetamide (CID 87995133) is 2,2,2-trifluoro-N-[2-(2-hydroxyethylamino)ethyl]acetamide.
What is the SMILES notation for 2,2,2-trifluoro-N-[2-(2-hydroxyethylamino)ethyl]acetamide?
The canonical SMILES for 2,2,2-trifluoro-N-[2-(2-hydroxyethylamino)ethyl]acetamide is O=C(NCCNCCO)C(F)(F)F.
What is the InChIKey of 2,2,2-trifluoro-N-[2-(2-hydroxyethylamino)ethyl]acetamide?
The InChIKey is AZWPFBJNQRPPDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11F3N2O2/c7-6(8,9)5(13)11-2-1-10-3-4-12/h10,12H,1-4H2,(H,11,13).
What are the key properties of 2,2,2-trifluoro-N-[2-(2-hydroxyethylamino)ethyl]acetamide?
2,2,2-trifluoro-N-[2-(2-hydroxyethylamino)ethyl]acetamide has a molecular weight of 200.16 g/mol, XLogP of -0.75, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,2-trifluoro-N-[2-(2-hydroxyethylamino)ethyl]acetamide is sourced from PubChem (CID 87995133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).