N-piperidin-3-yl-5-(trifluoromethoxy)pyridin-2-amine

C11H14F3N3O — CID 114280857

IUPACN-piperidin-3-yl-5-(trifluoromethoxy)pyridin-2-amine
SMILESFC(F)(F)Oc1ccc(NC2CCCNC2)nc1
InChIInChI=1S/C11H14F3N3O/c12-11(13,14)18-9-3-4-10(16-7-9)17-8-2-1-5-15-6-8/h3-4,7-8,15H,1-2,5-6H2,(H,16,17)
InChIKeyZNGNEHQSTFGWFN-UHFFFAOYSA-N
MW261.25 g/mol
LogP2.14
Rot. Bonds3

About N-piperidin-3-yl-5-(trifluoromethoxy)pyridin-2-amine

N-piperidin-3-yl-5-(trifluoromethoxy)pyridin-2-amine (PubChem CID 114280857) has the molecular formula C11H14F3N3O and a molecular weight of 261.25 g/mol. Its IUPAC name is N-piperidin-3-yl-5-(trifluoromethoxy)pyridin-2-amine.

Molecular Properties

Compound NameN-piperidin-3-yl-5-(trifluoromethoxy)pyridin-2-amine
PubChem CID114280857
Molecular FormulaC11H14F3N3O
Molecular Weight261.25 g/mol
Exact Mass261.11
IUPAC NameN-piperidin-3-yl-5-(trifluoromethoxy)pyridin-2-amine
SMILESFC(F)(F)Oc1ccc(NC2CCCNC2)nc1
InChIInChI=1S/C11H14F3N3O/c12-11(13,14)18-9-3-4-10(16-7-9)17-8-2-1-5-15-6-8/h3-4,7-8,15H,1-2,5-6H2,(H,16,17)
InChIKeyZNGNEHQSTFGWFN-UHFFFAOYSA-N
XLogP2.14
TPSA46.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.25
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-piperidin-3-yl-5-(trifluoromethoxy)pyridin-2-amine?
The IUPAC name of N-piperidin-3-yl-5-(trifluoromethoxy)pyridin-2-amine (CID 114280857) is N-piperidin-3-yl-5-(trifluoromethoxy)pyridin-2-amine.
What is the SMILES notation for N-piperidin-3-yl-5-(trifluoromethoxy)pyridin-2-amine?
The canonical SMILES for N-piperidin-3-yl-5-(trifluoromethoxy)pyridin-2-amine is FC(F)(F)Oc1ccc(NC2CCCNC2)nc1.
What is the InChIKey of N-piperidin-3-yl-5-(trifluoromethoxy)pyridin-2-amine?
The InChIKey is ZNGNEHQSTFGWFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14F3N3O/c12-11(13,14)18-9-3-4-10(16-7-9)17-8-2-1-5-15-6-8/h3-4,7-8,15H,1-2,5-6H2,(H,16,17).
What are the key properties of N-piperidin-3-yl-5-(trifluoromethoxy)pyridin-2-amine?
N-piperidin-3-yl-5-(trifluoromethoxy)pyridin-2-amine has a molecular weight of 261.25 g/mol, XLogP of 2.14, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-piperidin-3-yl-5-(trifluoromethoxy)pyridin-2-amine is sourced from PubChem (CID 114280857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).