6-methoxy-N-(oxan-3-yl)pyrimidin-4-amine

C10H15N3O2 — CID 66327033

IUPAC6-methoxy-N-(oxan-3-yl)pyrimidin-4-amine
SMILESCOc1cc(NC2CCCOC2)ncn1
InChIInChI=1S/C10H15N3O2/c1-14-10-5-9(11-7-12-10)13-8-3-2-4-15-6-8/h5,7-8H,2-4,6H2,1H3,(H,11,12,13)
InChIKeyGXKCTAABFGKKBI-UHFFFAOYSA-N
MW209.25 g/mol
LogP1.08
Rot. Bonds3

About 6-methoxy-N-(oxan-3-yl)pyrimidin-4-amine

6-methoxy-N-(oxan-3-yl)pyrimidin-4-amine (PubChem CID 66327033) has the molecular formula C10H15N3O2 and a molecular weight of 209.25 g/mol. Its IUPAC name is 6-methoxy-N-(oxan-3-yl)pyrimidin-4-amine.

Molecular Properties

Compound Name6-methoxy-N-(oxan-3-yl)pyrimidin-4-amine
PubChem CID66327033
Molecular FormulaC10H15N3O2
Molecular Weight209.25 g/mol
Exact Mass209.12
IUPAC Name6-methoxy-N-(oxan-3-yl)pyrimidin-4-amine
SMILESCOc1cc(NC2CCCOC2)ncn1
InChIInChI=1S/C10H15N3O2/c1-14-10-5-9(11-7-12-10)13-8-3-2-4-15-6-8/h5,7-8H,2-4,6H2,1H3,(H,11,12,13)
InChIKeyGXKCTAABFGKKBI-UHFFFAOYSA-N
XLogP1.08
TPSA56.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 51.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-methoxy-N-(oxan-3-yl)pyrimidin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-N-(oxan-3-yl)pyrimidin-4-amine?
The IUPAC name of 6-methoxy-N-(oxan-3-yl)pyrimidin-4-amine (CID 66327033) is 6-methoxy-N-(oxan-3-yl)pyrimidin-4-amine.
What is the SMILES notation for 6-methoxy-N-(oxan-3-yl)pyrimidin-4-amine?
The canonical SMILES for 6-methoxy-N-(oxan-3-yl)pyrimidin-4-amine is COc1cc(NC2CCCOC2)ncn1.
What is the InChIKey of 6-methoxy-N-(oxan-3-yl)pyrimidin-4-amine?
The InChIKey is GXKCTAABFGKKBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2/c1-14-10-5-9(11-7-12-10)13-8-3-2-4-15-6-8/h5,7-8H,2-4,6H2,1H3,(H,11,12,13).
What are the key properties of 6-methoxy-N-(oxan-3-yl)pyrimidin-4-amine?
6-methoxy-N-(oxan-3-yl)pyrimidin-4-amine has a molecular weight of 209.25 g/mol, XLogP of 1.08, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-N-(oxan-3-yl)pyrimidin-4-amine is sourced from PubChem (CID 66327033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).