2-amino-N-methyl-N-(2,2,2-trifluoroethyl)acetamide

C5H9F3N2O — CID 54595115

IUPAC2-amino-N-methyl-N-(2,2,2-trifluoroethyl)acetamide
SMILESCN(CC(F)(F)F)C(=O)CN
InChIInChI=1S/C5H9F3N2O/c1-10(4(11)2-9)3-5(6,7)8/h2-3,9H2,1H3
InChIKeyBPFYDKVLXKQPMD-UHFFFAOYSA-N
MW170.13 g/mol
LogP-0.03
Rot. Bonds2

About 2-amino-N-methyl-N-(2,2,2-trifluoroethyl)acetamide

2-amino-N-methyl-N-(2,2,2-trifluoroethyl)acetamide (PubChem CID 54595115) has the molecular formula C5H9F3N2O and a molecular weight of 170.13 g/mol. Its IUPAC name is 2-amino-N-methyl-N-(2,2,2-trifluoroethyl)acetamide.

Molecular Properties

Compound Name2-amino-N-methyl-N-(2,2,2-trifluoroethyl)acetamide
PubChem CID54595115
Molecular FormulaC5H9F3N2O
Molecular Weight170.13 g/mol
Exact Mass170.07
IUPAC Name2-amino-N-methyl-N-(2,2,2-trifluoroethyl)acetamide
SMILESCN(CC(F)(F)F)C(=O)CN
InChIInChI=1S/C5H9F3N2O/c1-10(4(11)2-9)3-5(6,7)8/h2-3,9H2,1H3
InChIKeyBPFYDKVLXKQPMD-UHFFFAOYSA-N
XLogP-0.03
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.13
LogP ≤ 5-0.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-methyl-N-(2,2,2-trifluoroethyl)acetamide?
The IUPAC name of 2-amino-N-methyl-N-(2,2,2-trifluoroethyl)acetamide (CID 54595115) is 2-amino-N-methyl-N-(2,2,2-trifluoroethyl)acetamide.
What is the SMILES notation for 2-amino-N-methyl-N-(2,2,2-trifluoroethyl)acetamide?
The canonical SMILES for 2-amino-N-methyl-N-(2,2,2-trifluoroethyl)acetamide is CN(CC(F)(F)F)C(=O)CN.
What is the InChIKey of 2-amino-N-methyl-N-(2,2,2-trifluoroethyl)acetamide?
The InChIKey is BPFYDKVLXKQPMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9F3N2O/c1-10(4(11)2-9)3-5(6,7)8/h2-3,9H2,1H3.
What are the key properties of 2-amino-N-methyl-N-(2,2,2-trifluoroethyl)acetamide?
2-amino-N-methyl-N-(2,2,2-trifluoroethyl)acetamide has a molecular weight of 170.13 g/mol, XLogP of -0.03, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-methyl-N-(2,2,2-trifluoroethyl)acetamide is sourced from PubChem (CID 54595115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).