6-methoxy-5-(trifluoromethyl)pyridine-2,3-diamine

C7H8F3N3O — CID 141196063

IUPAC6-methoxy-5-(trifluoromethyl)pyridine-2,3-diamine
SMILESCOc1nc(N)c(N)cc1C(F)(F)F
InChIInChI=1S/C7H8F3N3O/c1-14-6-3(7(8,9)10)2-4(11)5(12)13-6/h2H,11H2,1H3,(H2,12,13)
InChIKeyAURWCBXRAZWRBT-UHFFFAOYSA-N
MW207.16 g/mol
LogP1.27
Rot. Bonds1

About 6-methoxy-5-(trifluoromethyl)pyridine-2,3-diamine

6-methoxy-5-(trifluoromethyl)pyridine-2,3-diamine (PubChem CID 141196063) has the molecular formula C7H8F3N3O and a molecular weight of 207.16 g/mol. Its IUPAC name is 6-methoxy-5-(trifluoromethyl)pyridine-2,3-diamine.

Molecular Properties

Compound Name6-methoxy-5-(trifluoromethyl)pyridine-2,3-diamine
PubChem CID141196063
Molecular FormulaC7H8F3N3O
Molecular Weight207.16 g/mol
Exact Mass207.06
IUPAC Name6-methoxy-5-(trifluoromethyl)pyridine-2,3-diamine
SMILESCOc1nc(N)c(N)cc1C(F)(F)F
InChIInChI=1S/C7H8F3N3O/c1-14-6-3(7(8,9)10)2-4(11)5(12)13-6/h2H,11H2,1H3,(H2,12,13)
InChIKeyAURWCBXRAZWRBT-UHFFFAOYSA-N
XLogP1.27
TPSA74.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.16
LogP ≤ 51.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-methoxy-5-(trifluoromethyl)pyridine-2,3-diamine?
The IUPAC name of 6-methoxy-5-(trifluoromethyl)pyridine-2,3-diamine (CID 141196063) is 6-methoxy-5-(trifluoromethyl)pyridine-2,3-diamine.
What is the SMILES notation for 6-methoxy-5-(trifluoromethyl)pyridine-2,3-diamine?
The canonical SMILES for 6-methoxy-5-(trifluoromethyl)pyridine-2,3-diamine is COc1nc(N)c(N)cc1C(F)(F)F.
What is the InChIKey of 6-methoxy-5-(trifluoromethyl)pyridine-2,3-diamine?
The InChIKey is AURWCBXRAZWRBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8F3N3O/c1-14-6-3(7(8,9)10)2-4(11)5(12)13-6/h2H,11H2,1H3,(H2,12,13).
What are the key properties of 6-methoxy-5-(trifluoromethyl)pyridine-2,3-diamine?
6-methoxy-5-(trifluoromethyl)pyridine-2,3-diamine has a molecular weight of 207.16 g/mol, XLogP of 1.27, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-5-(trifluoromethyl)pyridine-2,3-diamine is sourced from PubChem (CID 141196063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).