2-methoxy-3-(trifluoromethyl)pyridin-4-amine

C7H7F3N2O — CID 118806319

IUPAC2-methoxy-3-(trifluoromethyl)pyridin-4-amine
SMILESCOc1nccc(N)c1C(F)(F)F
InChIInChI=1S/C7H7F3N2O/c1-13-6-5(7(8,9)10)4(11)2-3-12-6/h2-3H,1H3,(H2,11,12)
InChIKeyWZSAXXSQDKZBHW-UHFFFAOYSA-N
MW192.14 g/mol
LogP1.69
Rot. Bonds1

About 2-methoxy-3-(trifluoromethyl)pyridin-4-amine

2-methoxy-3-(trifluoromethyl)pyridin-4-amine (PubChem CID 118806319) has the molecular formula C7H7F3N2O and a molecular weight of 192.14 g/mol. Its IUPAC name is 2-methoxy-3-(trifluoromethyl)pyridin-4-amine.

Molecular Properties

Compound Name2-methoxy-3-(trifluoromethyl)pyridin-4-amine
PubChem CID118806319
Molecular FormulaC7H7F3N2O
Molecular Weight192.14 g/mol
Exact Mass192.05
IUPAC Name2-methoxy-3-(trifluoromethyl)pyridin-4-amine
SMILESCOc1nccc(N)c1C(F)(F)F
InChIInChI=1S/C7H7F3N2O/c1-13-6-5(7(8,9)10)4(11)2-3-12-6/h2-3H,1H3,(H2,11,12)
InChIKeyWZSAXXSQDKZBHW-UHFFFAOYSA-N
XLogP1.69
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.14
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-3-(trifluoromethyl)pyridin-4-amine?
The IUPAC name of 2-methoxy-3-(trifluoromethyl)pyridin-4-amine (CID 118806319) is 2-methoxy-3-(trifluoromethyl)pyridin-4-amine.
What is the SMILES notation for 2-methoxy-3-(trifluoromethyl)pyridin-4-amine?
The canonical SMILES for 2-methoxy-3-(trifluoromethyl)pyridin-4-amine is COc1nccc(N)c1C(F)(F)F.
What is the InChIKey of 2-methoxy-3-(trifluoromethyl)pyridin-4-amine?
The InChIKey is WZSAXXSQDKZBHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7F3N2O/c1-13-6-5(7(8,9)10)4(11)2-3-12-6/h2-3H,1H3,(H2,11,12).
What are the key properties of 2-methoxy-3-(trifluoromethyl)pyridin-4-amine?
2-methoxy-3-(trifluoromethyl)pyridin-4-amine has a molecular weight of 192.14 g/mol, XLogP of 1.69, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-3-(trifluoromethyl)pyridin-4-amine is sourced from PubChem (CID 118806319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).