6-[(2-methylpropan-2-yl)oxy]-5-propan-2-ylpyrimidin-4-amine

C11H19N3O — CID 80861603

IUPAC6-[(2-methylpropan-2-yl)oxy]-5-propan-2-ylpyrimidin-4-amine
SMILESCC(C)c1c(N)ncnc1OC(C)(C)C
InChIInChI=1S/C11H19N3O/c1-7(2)8-9(12)13-6-14-10(8)15-11(3,4)5/h6-7H,1-5H3,(H2,12,13,14)
InChIKeyBRPWIGOGXQITGZ-UHFFFAOYSA-N
MW209.29 g/mol
LogP2.36
Rot. Bonds2

About 6-[(2-methylpropan-2-yl)oxy]-5-propan-2-ylpyrimidin-4-amine

6-[(2-methylpropan-2-yl)oxy]-5-propan-2-ylpyrimidin-4-amine (PubChem CID 80861603) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is 6-[(2-methylpropan-2-yl)oxy]-5-propan-2-ylpyrimidin-4-amine.

Molecular Properties

Compound Name6-[(2-methylpropan-2-yl)oxy]-5-propan-2-ylpyrimidin-4-amine
PubChem CID80861603
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name6-[(2-methylpropan-2-yl)oxy]-5-propan-2-ylpyrimidin-4-amine
SMILESCC(C)c1c(N)ncnc1OC(C)(C)C
InChIInChI=1S/C11H19N3O/c1-7(2)8-9(12)13-6-14-10(8)15-11(3,4)5/h6-7H,1-5H3,(H2,12,13,14)
InChIKeyBRPWIGOGXQITGZ-UHFFFAOYSA-N
XLogP2.36
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-[(2-methylpropan-2-yl)oxy]-5-propan-2-ylpyrimidin-4-amine?
The IUPAC name of 6-[(2-methylpropan-2-yl)oxy]-5-propan-2-ylpyrimidin-4-amine (CID 80861603) is 6-[(2-methylpropan-2-yl)oxy]-5-propan-2-ylpyrimidin-4-amine.
What is the SMILES notation for 6-[(2-methylpropan-2-yl)oxy]-5-propan-2-ylpyrimidin-4-amine?
The canonical SMILES for 6-[(2-methylpropan-2-yl)oxy]-5-propan-2-ylpyrimidin-4-amine is CC(C)c1c(N)ncnc1OC(C)(C)C.
What is the InChIKey of 6-[(2-methylpropan-2-yl)oxy]-5-propan-2-ylpyrimidin-4-amine?
The InChIKey is BRPWIGOGXQITGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-7(2)8-9(12)13-6-14-10(8)15-11(3,4)5/h6-7H,1-5H3,(H2,12,13,14).
What are the key properties of 6-[(2-methylpropan-2-yl)oxy]-5-propan-2-ylpyrimidin-4-amine?
6-[(2-methylpropan-2-yl)oxy]-5-propan-2-ylpyrimidin-4-amine has a molecular weight of 209.29 g/mol, XLogP of 2.36, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(2-methylpropan-2-yl)oxy]-5-propan-2-ylpyrimidin-4-amine is sourced from PubChem (CID 80861603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).