6-(2-cyclobutylethoxy)-5-methoxypyrimidin-4-amine

C11H17N3O2 — CID 106207794

IUPAC6-(2-cyclobutylethoxy)-5-methoxypyrimidin-4-amine
SMILESCOc1c(N)ncnc1OCCC1CCC1
InChIInChI=1S/C11H17N3O2/c1-15-9-10(12)13-7-14-11(9)16-6-5-8-3-2-4-8/h7-8H,2-6H2,1H3,(H2,12,13,14)
InChIKeyDAFYWZCVRMNZFQ-UHFFFAOYSA-N
MW223.28 g/mol
LogP1.64
Rot. Bonds5

About 6-(2-cyclobutylethoxy)-5-methoxypyrimidin-4-amine

6-(2-cyclobutylethoxy)-5-methoxypyrimidin-4-amine (PubChem CID 106207794) has the molecular formula C11H17N3O2 and a molecular weight of 223.28 g/mol. Its IUPAC name is 6-(2-cyclobutylethoxy)-5-methoxypyrimidin-4-amine.

Molecular Properties

Compound Name6-(2-cyclobutylethoxy)-5-methoxypyrimidin-4-amine
PubChem CID106207794
Molecular FormulaC11H17N3O2
Molecular Weight223.28 g/mol
Exact Mass223.13
IUPAC Name6-(2-cyclobutylethoxy)-5-methoxypyrimidin-4-amine
SMILESCOc1c(N)ncnc1OCCC1CCC1
InChIInChI=1S/C11H17N3O2/c1-15-9-10(12)13-7-14-11(9)16-6-5-8-3-2-4-8/h7-8H,2-6H2,1H3,(H2,12,13,14)
InChIKeyDAFYWZCVRMNZFQ-UHFFFAOYSA-N
XLogP1.64
TPSA70.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(2-cyclobutylethoxy)-5-methoxypyrimidin-4-amine?
The IUPAC name of 6-(2-cyclobutylethoxy)-5-methoxypyrimidin-4-amine (CID 106207794) is 6-(2-cyclobutylethoxy)-5-methoxypyrimidin-4-amine.
What is the SMILES notation for 6-(2-cyclobutylethoxy)-5-methoxypyrimidin-4-amine?
The canonical SMILES for 6-(2-cyclobutylethoxy)-5-methoxypyrimidin-4-amine is COc1c(N)ncnc1OCCC1CCC1.
What is the InChIKey of 6-(2-cyclobutylethoxy)-5-methoxypyrimidin-4-amine?
The InChIKey is DAFYWZCVRMNZFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2/c1-15-9-10(12)13-7-14-11(9)16-6-5-8-3-2-4-8/h7-8H,2-6H2,1H3,(H2,12,13,14).
What are the key properties of 6-(2-cyclobutylethoxy)-5-methoxypyrimidin-4-amine?
6-(2-cyclobutylethoxy)-5-methoxypyrimidin-4-amine has a molecular weight of 223.28 g/mol, XLogP of 1.64, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-cyclobutylethoxy)-5-methoxypyrimidin-4-amine is sourced from PubChem (CID 106207794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).