5-methoxy-2-(oxan-4-yl)pyridin-4-amine

C11H16N2O2 — CID 58962706

IUPAC5-methoxy-2-(oxan-4-yl)pyridin-4-amine
SMILESCOc1cnc(C2CCOCC2)cc1N
InChIInChI=1S/C11H16N2O2/c1-14-11-7-13-10(6-9(11)12)8-2-4-15-5-3-8/h6-8H,2-5H2,1H3,(H2,12,13)
InChIKeyYQOAWNCUGVHCBA-UHFFFAOYSA-N
MW208.26 g/mol
LogP1.57
Rot. Bonds2

About 5-methoxy-2-(oxan-4-yl)pyridin-4-amine

5-methoxy-2-(oxan-4-yl)pyridin-4-amine (PubChem CID 58962706) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is 5-methoxy-2-(oxan-4-yl)pyridin-4-amine.

Molecular Properties

Compound Name5-methoxy-2-(oxan-4-yl)pyridin-4-amine
PubChem CID58962706
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC Name5-methoxy-2-(oxan-4-yl)pyridin-4-amine
SMILESCOc1cnc(C2CCOCC2)cc1N
InChIInChI=1S/C11H16N2O2/c1-14-11-7-13-10(6-9(11)12)8-2-4-15-5-3-8/h6-8H,2-5H2,1H3,(H2,12,13)
InChIKeyYQOAWNCUGVHCBA-UHFFFAOYSA-N
XLogP1.57
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-methoxy-2-(oxan-4-yl)pyridin-4-amine?
The IUPAC name of 5-methoxy-2-(oxan-4-yl)pyridin-4-amine (CID 58962706) is 5-methoxy-2-(oxan-4-yl)pyridin-4-amine.
What is the SMILES notation for 5-methoxy-2-(oxan-4-yl)pyridin-4-amine?
The canonical SMILES for 5-methoxy-2-(oxan-4-yl)pyridin-4-amine is COc1cnc(C2CCOCC2)cc1N.
What is the InChIKey of 5-methoxy-2-(oxan-4-yl)pyridin-4-amine?
The InChIKey is YQOAWNCUGVHCBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c1-14-11-7-13-10(6-9(11)12)8-2-4-15-5-3-8/h6-8H,2-5H2,1H3,(H2,12,13).
What are the key properties of 5-methoxy-2-(oxan-4-yl)pyridin-4-amine?
5-methoxy-2-(oxan-4-yl)pyridin-4-amine has a molecular weight of 208.26 g/mol, XLogP of 1.57, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-2-(oxan-4-yl)pyridin-4-amine is sourced from PubChem (CID 58962706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).