N-(oxolan-3-yl)-6-(trifluoromethyl)pyridin-3-amine

C10H11F3N2O — CID 82811665

IUPACN-(oxolan-3-yl)-6-(trifluoromethyl)pyridin-3-amine
SMILESFC(F)(F)c1ccc(NC2CCOC2)cn1
InChIInChI=1S/C10H11F3N2O/c11-10(12,13)9-2-1-7(5-14-9)15-8-3-4-16-6-8/h1-2,5,8,15H,3-4,6H2
InChIKeyYPACMQQRGUPTOW-UHFFFAOYSA-N
MW232.20 g/mol
LogP2.30
Rot. Bonds2

About N-(oxolan-3-yl)-6-(trifluoromethyl)pyridin-3-amine

N-(oxolan-3-yl)-6-(trifluoromethyl)pyridin-3-amine (PubChem CID 82811665) has the molecular formula C10H11F3N2O and a molecular weight of 232.20 g/mol. Its IUPAC name is N-(oxolan-3-yl)-6-(trifluoromethyl)pyridin-3-amine.

Molecular Properties

Compound NameN-(oxolan-3-yl)-6-(trifluoromethyl)pyridin-3-amine
PubChem CID82811665
Molecular FormulaC10H11F3N2O
Molecular Weight232.20 g/mol
Exact Mass232.08
IUPAC NameN-(oxolan-3-yl)-6-(trifluoromethyl)pyridin-3-amine
SMILESFC(F)(F)c1ccc(NC2CCOC2)cn1
InChIInChI=1S/C10H11F3N2O/c11-10(12,13)9-2-1-7(5-14-9)15-8-3-4-16-6-8/h1-2,5,8,15H,3-4,6H2
InChIKeyYPACMQQRGUPTOW-UHFFFAOYSA-N
XLogP2.30
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.20
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(oxolan-3-yl)-6-(trifluoromethyl)pyridin-3-amine?
The IUPAC name of N-(oxolan-3-yl)-6-(trifluoromethyl)pyridin-3-amine (CID 82811665) is N-(oxolan-3-yl)-6-(trifluoromethyl)pyridin-3-amine.
What is the SMILES notation for N-(oxolan-3-yl)-6-(trifluoromethyl)pyridin-3-amine?
The canonical SMILES for N-(oxolan-3-yl)-6-(trifluoromethyl)pyridin-3-amine is FC(F)(F)c1ccc(NC2CCOC2)cn1.
What is the InChIKey of N-(oxolan-3-yl)-6-(trifluoromethyl)pyridin-3-amine?
The InChIKey is YPACMQQRGUPTOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11F3N2O/c11-10(12,13)9-2-1-7(5-14-9)15-8-3-4-16-6-8/h1-2,5,8,15H,3-4,6H2.
What are the key properties of N-(oxolan-3-yl)-6-(trifluoromethyl)pyridin-3-amine?
N-(oxolan-3-yl)-6-(trifluoromethyl)pyridin-3-amine has a molecular weight of 232.20 g/mol, XLogP of 2.30, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(oxolan-3-yl)-6-(trifluoromethyl)pyridin-3-amine is sourced from PubChem (CID 82811665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).