4-(oxolan-3-yloxy)-6-(trifluoromethyl)pyridin-3-amine

C10H11F3N2O2 — CID 106748469

IUPAC4-(oxolan-3-yloxy)-6-(trifluoromethyl)pyridin-3-amine
SMILESNc1cnc(C(F)(F)F)cc1OC1CCOC1
InChIInChI=1S/C10H11F3N2O2/c11-10(12,13)9-3-8(7(14)4-15-9)17-6-1-2-16-5-6/h3-4,6H,1-2,5,14H2
InChIKeyOLRMLYNLZNMDPM-UHFFFAOYSA-N
MW248.20 g/mol
LogP1.85
Rot. Bonds2

About 4-(oxolan-3-yloxy)-6-(trifluoromethyl)pyridin-3-amine

4-(oxolan-3-yloxy)-6-(trifluoromethyl)pyridin-3-amine (PubChem CID 106748469) has the molecular formula C10H11F3N2O2 and a molecular weight of 248.20 g/mol. Its IUPAC name is 4-(oxolan-3-yloxy)-6-(trifluoromethyl)pyridin-3-amine.

Molecular Properties

Compound Name4-(oxolan-3-yloxy)-6-(trifluoromethyl)pyridin-3-amine
PubChem CID106748469
Molecular FormulaC10H11F3N2O2
Molecular Weight248.20 g/mol
Exact Mass248.08
IUPAC Name4-(oxolan-3-yloxy)-6-(trifluoromethyl)pyridin-3-amine
SMILESNc1cnc(C(F)(F)F)cc1OC1CCOC1
InChIInChI=1S/C10H11F3N2O2/c11-10(12,13)9-3-8(7(14)4-15-9)17-6-1-2-16-5-6/h3-4,6H,1-2,5,14H2
InChIKeyOLRMLYNLZNMDPM-UHFFFAOYSA-N
XLogP1.85
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.20
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(oxolan-3-yloxy)-6-(trifluoromethyl)pyridin-3-amine?
The IUPAC name of 4-(oxolan-3-yloxy)-6-(trifluoromethyl)pyridin-3-amine (CID 106748469) is 4-(oxolan-3-yloxy)-6-(trifluoromethyl)pyridin-3-amine.
What is the SMILES notation for 4-(oxolan-3-yloxy)-6-(trifluoromethyl)pyridin-3-amine?
The canonical SMILES for 4-(oxolan-3-yloxy)-6-(trifluoromethyl)pyridin-3-amine is Nc1cnc(C(F)(F)F)cc1OC1CCOC1.
What is the InChIKey of 4-(oxolan-3-yloxy)-6-(trifluoromethyl)pyridin-3-amine?
The InChIKey is OLRMLYNLZNMDPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11F3N2O2/c11-10(12,13)9-3-8(7(14)4-15-9)17-6-1-2-16-5-6/h3-4,6H,1-2,5,14H2.
What are the key properties of 4-(oxolan-3-yloxy)-6-(trifluoromethyl)pyridin-3-amine?
4-(oxolan-3-yloxy)-6-(trifluoromethyl)pyridin-3-amine has a molecular weight of 248.20 g/mol, XLogP of 1.85, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(oxolan-3-yloxy)-6-(trifluoromethyl)pyridin-3-amine is sourced from PubChem (CID 106748469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).