2-amino-N-ethylacetamide;2,2,2-trifluoroacetic acid

C6H11F3N2O3 — CID 89106948

IUPAC2-amino-N-ethylacetamide;2,2,2-trifluoroacetic acid
SMILESCCNC(=O)CN.O=C(O)C(F)(F)F
InChIInChI=1S/C4H10N2O.C2HF3O2/c1-2-6-4(7)3-5;3-2(4,5)1(6)7/h2-3,5H2,1H3,(H,6,7);(H,6,7)
InChIKeyJLQTZRYCVZNIFM-UHFFFAOYSA-N
MW216.16 g/mol
LogP-0.29
Rot. Bonds2

About 2-amino-N-ethylacetamide;2,2,2-trifluoroacetic acid

2-amino-N-ethylacetamide;2,2,2-trifluoroacetic acid (PubChem CID 89106948) has the molecular formula C6H11F3N2O3 and a molecular weight of 216.16 g/mol. Its IUPAC name is 2-amino-N-ethylacetamide;2,2,2-trifluoroacetic acid.

Molecular Properties

Compound Name2-amino-N-ethylacetamide;2,2,2-trifluoroacetic acid
PubChem CID89106948
Molecular FormulaC6H11F3N2O3
Molecular Weight216.16 g/mol
Exact Mass216.07
IUPAC Name2-amino-N-ethylacetamide;2,2,2-trifluoroacetic acid
SMILESCCNC(=O)CN.O=C(O)C(F)(F)F
InChIInChI=1S/C4H10N2O.C2HF3O2/c1-2-6-4(7)3-5;3-2(4,5)1(6)7/h2-3,5H2,1H3,(H,6,7);(H,6,7)
InChIKeyJLQTZRYCVZNIFM-UHFFFAOYSA-N
XLogP-0.29
TPSA92.42 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.16
LogP ≤ 5-0.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-ethylacetamide;2,2,2-trifluoroacetic acid?
The IUPAC name of 2-amino-N-ethylacetamide;2,2,2-trifluoroacetic acid (CID 89106948) is 2-amino-N-ethylacetamide;2,2,2-trifluoroacetic acid.
What is the SMILES notation for 2-amino-N-ethylacetamide;2,2,2-trifluoroacetic acid?
The canonical SMILES for 2-amino-N-ethylacetamide;2,2,2-trifluoroacetic acid is CCNC(=O)CN.O=C(O)C(F)(F)F.
What is the InChIKey of 2-amino-N-ethylacetamide;2,2,2-trifluoroacetic acid?
The InChIKey is JLQTZRYCVZNIFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10N2O.C2HF3O2/c1-2-6-4(7)3-5;3-2(4,5)1(6)7/h2-3,5H2,1H3,(H,6,7);(H,6,7).
What are the key properties of 2-amino-N-ethylacetamide;2,2,2-trifluoroacetic acid?
2-amino-N-ethylacetamide;2,2,2-trifluoroacetic acid has a molecular weight of 216.16 g/mol, XLogP of -0.29, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-ethylacetamide;2,2,2-trifluoroacetic acid is sourced from PubChem (CID 89106948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).