7-(trifluoromethyl)-[1,2]oxazolo[5,4-c]pyridin-3-amine

C7H4F3N3O — CID 68506381

IUPAC7-(trifluoromethyl)-[1,2]oxazolo[5,4-c]pyridin-3-amine
SMILESNc1noc2c(C(F)(F)F)nccc12
InChIInChI=1S/C7H4F3N3O/c8-7(9,10)5-4-3(1-2-12-5)6(11)13-14-4/h1-2H,(H2,11,13)
InChIKeyANPVSEZLFYKTQR-UHFFFAOYSA-N
MW203.12 g/mol
LogP1.82
Rot. Bonds

About 7-(trifluoromethyl)-[1,2]oxazolo[5,4-c]pyridin-3-amine

7-(trifluoromethyl)-[1,2]oxazolo[5,4-c]pyridin-3-amine (PubChem CID 68506381) has the molecular formula C7H4F3N3O and a molecular weight of 203.12 g/mol. Its IUPAC name is 7-(trifluoromethyl)-[1,2]oxazolo[5,4-c]pyridin-3-amine.

Molecular Properties

Compound Name7-(trifluoromethyl)-[1,2]oxazolo[5,4-c]pyridin-3-amine
PubChem CID68506381
Molecular FormulaC7H4F3N3O
Molecular Weight203.12 g/mol
Exact Mass203.03
IUPAC Name7-(trifluoromethyl)-[1,2]oxazolo[5,4-c]pyridin-3-amine
SMILESNc1noc2c(C(F)(F)F)nccc12
InChIInChI=1S/C7H4F3N3O/c8-7(9,10)5-4-3(1-2-12-5)6(11)13-14-4/h1-2H,(H2,11,13)
InChIKeyANPVSEZLFYKTQR-UHFFFAOYSA-N
XLogP1.82
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.12
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-(trifluoromethyl)-[1,2]oxazolo[5,4-c]pyridin-3-amine?
The IUPAC name of 7-(trifluoromethyl)-[1,2]oxazolo[5,4-c]pyridin-3-amine (CID 68506381) is 7-(trifluoromethyl)-[1,2]oxazolo[5,4-c]pyridin-3-amine.
What is the SMILES notation for 7-(trifluoromethyl)-[1,2]oxazolo[5,4-c]pyridin-3-amine?
The canonical SMILES for 7-(trifluoromethyl)-[1,2]oxazolo[5,4-c]pyridin-3-amine is Nc1noc2c(C(F)(F)F)nccc12.
What is the InChIKey of 7-(trifluoromethyl)-[1,2]oxazolo[5,4-c]pyridin-3-amine?
The InChIKey is ANPVSEZLFYKTQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H4F3N3O/c8-7(9,10)5-4-3(1-2-12-5)6(11)13-14-4/h1-2H,(H2,11,13).
What are the key properties of 7-(trifluoromethyl)-[1,2]oxazolo[5,4-c]pyridin-3-amine?
7-(trifluoromethyl)-[1,2]oxazolo[5,4-c]pyridin-3-amine has a molecular weight of 203.12 g/mol, XLogP of 1.82, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(trifluoromethyl)-[1,2]oxazolo[5,4-c]pyridin-3-amine is sourced from PubChem (CID 68506381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).