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

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Related Compounds

6-ethoxy-N-(oxolan-3-yl)pyrimidin-4-amine
CID 80713528
4-methoxy-N-(oxan-3-yl)pyridin-2-amine
CID 115922910
4-N-[(2S,6R)-2,6-dimethyloxan-4-yl]-6-N-[(3R)-oxan-3-yl]pyrimidine-4,6-diamine
CID 129333350
6-methoxy-N-piperidin-4-ylpyrimidin-4-amine
CID 66319414
4-N-(6-methoxypyrimidin-4-yl)cyclohexane-1,4-diamine
CID 66318521
N-(3,5-dimethylcyclohexyl)-6-methoxypyrimidin-4-amine
CID 66326824
N-(azetidin-3-yl)-6-methoxypyrimidin-4-amine
CID 66319421
[(2R)-1-[6-[[(3R)-oxan-3-yl]amino]pyrimidin-4-yl]pyrrolidin-2-yl]methanol
CID 95758167
6-N-(2-methyl-2-methylsulfanylpropyl)-4-N-[(3R)-oxan-3-yl]pyrimidine-4,6-diamine
CID 129333149
6-(1,3-dihydroisoindol-2-yl)-N-[(3R)-oxan-3-yl]pyrimidin-4-amine
CID 129339877
2-N-[(2-methoxy-4-pyridinyl)methyl]-4-N-[(3R)-oxan-3-yl]pyrimidine-2,4-diamine
CID 129333487
1-methyl-4-[6-[[(3R)-oxan-3-yl]amino]pyrimidin-4-yl]piperazin-2-one
CID 129398746

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).