2-(aminomethyl)-4-(trifluoromethoxy)pyridin-3-ol

C7H7F3N2O2 — CID 118836970

IUPAC2-(aminomethyl)-4-(trifluoromethoxy)pyridin-3-ol
SMILESNCc1nccc(OC(F)(F)F)c1O
InChIInChI=1S/C7H7F3N2O2/c8-7(9,10)14-5-1-2-12-4(3-11)6(5)13/h1-2,13H,3,11H2
InChIKeyQJTVBKGUGNKGNW-UHFFFAOYSA-N
MW208.14 g/mol
LogP1.14
Rot. Bonds2

About 2-(aminomethyl)-4-(trifluoromethoxy)pyridin-3-ol

2-(aminomethyl)-4-(trifluoromethoxy)pyridin-3-ol (PubChem CID 118836970) has the molecular formula C7H7F3N2O2 and a molecular weight of 208.14 g/mol. Its IUPAC name is 2-(aminomethyl)-4-(trifluoromethoxy)pyridin-3-ol.

Molecular Properties

Compound Name2-(aminomethyl)-4-(trifluoromethoxy)pyridin-3-ol
PubChem CID118836970
Molecular FormulaC7H7F3N2O2
Molecular Weight208.14 g/mol
Exact Mass208.05
IUPAC Name2-(aminomethyl)-4-(trifluoromethoxy)pyridin-3-ol
SMILESNCc1nccc(OC(F)(F)F)c1O
InChIInChI=1S/C7H7F3N2O2/c8-7(9,10)14-5-1-2-12-4(3-11)6(5)13/h1-2,13H,3,11H2
InChIKeyQJTVBKGUGNKGNW-UHFFFAOYSA-N
XLogP1.14
TPSA68.37 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.14
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(aminomethyl)-4-(hydroxymethyl)-5-(trifluoromethoxy)pyridin-3-ol
CID 118825651
[4-methoxy-3-(trifluoromethoxy)-2-pyridinyl]methanamine
CID 118814252
[2-iodo-4-(trifluoromethoxy)-3-pyridinyl]methanamine
CID 130092403
[4-methyl-3-(trifluoromethoxy)-2-pyridinyl]methanamine
CID 118831271
[2-(aminomethyl)-3-(difluoromethyl)-5-(trifluoromethoxy)-4-pyridinyl]methanol
CID 118825588
2-fluoro-6-(trifluoromethoxy)phenol
CID 68960936
2-(aminomethyl)-4-methyl-5-(trifluoromethoxy)pyridin-3-amine
CID 133086262
6-(aminomethyl)-2-(difluoromethyl)-5-(trifluoromethoxy)pyridin-3-ol
CID 118842664
ethyl 2-[6-(aminomethyl)-5-hydroxy-4-(trifluoromethoxy)-3-pyridinyl]acetate
CID 134680236
6-(aminomethyl)-5-hydroxy-3-(trifluoromethoxy)pyridine-2-carboxylic acid
CID 118819823
6-(aminomethyl)-2-(trifluoromethoxy)-5-(trifluoromethyl)pyridin-3-ol
CID 134680204
2-(cyanomethyl)-4-(trifluoromethoxy)pyridine-3-carbonitrile
CID 133095482

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-4-(trifluoromethoxy)pyridin-3-ol?
The IUPAC name of 2-(aminomethyl)-4-(trifluoromethoxy)pyridin-3-ol (CID 118836970) is 2-(aminomethyl)-4-(trifluoromethoxy)pyridin-3-ol.
What is the SMILES notation for 2-(aminomethyl)-4-(trifluoromethoxy)pyridin-3-ol?
The canonical SMILES for 2-(aminomethyl)-4-(trifluoromethoxy)pyridin-3-ol is NCc1nccc(OC(F)(F)F)c1O.
What is the InChIKey of 2-(aminomethyl)-4-(trifluoromethoxy)pyridin-3-ol?
The InChIKey is QJTVBKGUGNKGNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7F3N2O2/c8-7(9,10)14-5-1-2-12-4(3-11)6(5)13/h1-2,13H,3,11H2.
What are the key properties of 2-(aminomethyl)-4-(trifluoromethoxy)pyridin-3-ol?
2-(aminomethyl)-4-(trifluoromethoxy)pyridin-3-ol has a molecular weight of 208.14 g/mol, XLogP of 1.14, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-4-(trifluoromethoxy)pyridin-3-ol is sourced from PubChem (CID 118836970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).