2-[[6-(trifluoromethyl)-2-pyridinyl]amino]acetic acid

C8H7F3N2O2 — CID 51063993

IUPAC2-[[6-(trifluoromethyl)-2-pyridinyl]amino]acetic acid
SMILESO=C(O)CNc1cccc(C(F)(F)F)n1
InChIInChI=1S/C8H7F3N2O2/c9-8(10,11)5-2-1-3-6(13-5)12-4-7(14)15/h1-3H,4H2,(H,12,13)(H,14,15)
InChIKeyKKIOYWDQZJOMOJ-UHFFFAOYSA-N
MW220.15 g/mol
LogP1.60
Rot. Bonds3

About 2-[[6-(trifluoromethyl)-2-pyridinyl]amino]acetic acid

2-[[6-(trifluoromethyl)-2-pyridinyl]amino]acetic acid (PubChem CID 51063993) has the molecular formula C8H7F3N2O2 and a molecular weight of 220.15 g/mol. Its IUPAC name is 2-[[6-(trifluoromethyl)-2-pyridinyl]amino]acetic acid.

Molecular Properties

Compound Name2-[[6-(trifluoromethyl)-2-pyridinyl]amino]acetic acid
PubChem CID51063993
Molecular FormulaC8H7F3N2O2
Molecular Weight220.15 g/mol
Exact Mass220.05
IUPAC Name2-[[6-(trifluoromethyl)-2-pyridinyl]amino]acetic acid
SMILESO=C(O)CNc1cccc(C(F)(F)F)n1
InChIInChI=1S/C8H7F3N2O2/c9-8(10,11)5-2-1-3-6(13-5)12-4-7(14)15/h1-3H,4H2,(H,12,13)(H,14,15)
InChIKeyKKIOYWDQZJOMOJ-UHFFFAOYSA-N
XLogP1.60
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.15
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-methyl-3-[[6-(trifluoromethyl)-2-pyridinyl]amino]butanoic acid
CID 64699610
1,1,1-trifluoro-3-[[6-(trifluoromethyl)-2-pyridinyl]amino]propan-2-ol
CID 113228906
1-(4-benzylpiperidin-1-yl)-2-[[6-(trifluoromethyl)-2-pyridinyl]amino]ethanone
CID 133342535
2-[6-(trifluoromethyl)-2-pyridinyl]acetic acid
CID 53401513
(2S,3S)-3-methyl-2-[[6-(trifluoromethyl)-2-pyridinyl]amino]pentanoic acid
CID 120964651
2-[[6-(trifluoromethyl)-2-pyridinyl]amino]propane-1,3-diol
CID 65314262
[1-[[6-(trifluoromethyl)-2-pyridinyl]amino]cyclohexyl]methanol
CID 62520440
N-[[4-(chloromethyl)phenyl]methyl]-6-(trifluoromethyl)pyridin-2-amine
CID 107233089
N-octyl-6-(trifluoromethyl)pyridin-2-amine
CID 115568965
N-[2-(1H-imidazol-5-yl)ethyl]-6-(trifluoromethyl)pyridin-2-amine
CID 65232549
4-[[6-(trifluoromethyl)-2-pyridinyl]amino]cyclopent-2-ene-1-carboxylic acid
CID 79216609
N-(thiophen-3-ylmethyl)-6-(trifluoromethyl)pyridin-2-amine
CID 62315277

Frequently Asked Questions

What is the IUPAC name of 2-[[6-(trifluoromethyl)-2-pyridinyl]amino]acetic acid?
The IUPAC name of 2-[[6-(trifluoromethyl)-2-pyridinyl]amino]acetic acid (CID 51063993) is 2-[[6-(trifluoromethyl)-2-pyridinyl]amino]acetic acid.
What is the SMILES notation for 2-[[6-(trifluoromethyl)-2-pyridinyl]amino]acetic acid?
The canonical SMILES for 2-[[6-(trifluoromethyl)-2-pyridinyl]amino]acetic acid is O=C(O)CNc1cccc(C(F)(F)F)n1.
What is the InChIKey of 2-[[6-(trifluoromethyl)-2-pyridinyl]amino]acetic acid?
The InChIKey is KKIOYWDQZJOMOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7F3N2O2/c9-8(10,11)5-2-1-3-6(13-5)12-4-7(14)15/h1-3H,4H2,(H,12,13)(H,14,15).
What are the key properties of 2-[[6-(trifluoromethyl)-2-pyridinyl]amino]acetic acid?
2-[[6-(trifluoromethyl)-2-pyridinyl]amino]acetic acid has a molecular weight of 220.15 g/mol, XLogP of 1.60, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[6-(trifluoromethyl)-2-pyridinyl]amino]acetic acid is sourced from PubChem (CID 51063993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).