4-methoxy-N-(oxan-3-yl)pyridin-2-amine

C11H16N2O2 — CID 115922910

IUPAC4-methoxy-N-(oxan-3-yl)pyridin-2-amine
SMILESCOc1ccnc(NC2CCCOC2)c1
InChIInChI=1S/C11H16N2O2/c1-14-10-4-5-12-11(7-10)13-9-3-2-6-15-8-9/h4-5,7,9H,2-3,6,8H2,1H3,(H,12,13)
InChIKeyJAUWRNMVEVVHEM-UHFFFAOYSA-N
MW208.26 g/mol
LogP1.68
Rot. Bonds3

About 4-methoxy-N-(oxan-3-yl)pyridin-2-amine

4-methoxy-N-(oxan-3-yl)pyridin-2-amine (PubChem CID 115922910) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is 4-methoxy-N-(oxan-3-yl)pyridin-2-amine.

Molecular Properties

Compound Name4-methoxy-N-(oxan-3-yl)pyridin-2-amine
PubChem CID115922910
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC Name4-methoxy-N-(oxan-3-yl)pyridin-2-amine
SMILESCOc1ccnc(NC2CCCOC2)c1
InChIInChI=1S/C11H16N2O2/c1-14-10-4-5-12-11(7-10)13-9-3-2-6-15-8-9/h4-5,7,9H,2-3,6,8H2,1H3,(H,12,13)
InChIKeyJAUWRNMVEVVHEM-UHFFFAOYSA-N
XLogP1.68
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-(oxan-3-yl)pyridin-2-amine?
The IUPAC name of 4-methoxy-N-(oxan-3-yl)pyridin-2-amine (CID 115922910) is 4-methoxy-N-(oxan-3-yl)pyridin-2-amine.
What is the SMILES notation for 4-methoxy-N-(oxan-3-yl)pyridin-2-amine?
The canonical SMILES for 4-methoxy-N-(oxan-3-yl)pyridin-2-amine is COc1ccnc(NC2CCCOC2)c1.
What is the InChIKey of 4-methoxy-N-(oxan-3-yl)pyridin-2-amine?
The InChIKey is JAUWRNMVEVVHEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c1-14-10-4-5-12-11(7-10)13-9-3-2-6-15-8-9/h4-5,7,9H,2-3,6,8H2,1H3,(H,12,13).
What are the key properties of 4-methoxy-N-(oxan-3-yl)pyridin-2-amine?
4-methoxy-N-(oxan-3-yl)pyridin-2-amine has a molecular weight of 208.26 g/mol, XLogP of 1.68, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-(oxan-3-yl)pyridin-2-amine is sourced from PubChem (CID 115922910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).