5-ethyl-6-pentan-2-yloxypyrimidin-4-amine

C11H19N3O — CID 102989268

IUPAC5-ethyl-6-pentan-2-yloxypyrimidin-4-amine
SMILESCCCC(C)Oc1ncnc(N)c1CC
InChIInChI=1S/C11H19N3O/c1-4-6-8(3)15-11-9(5-2)10(12)13-7-14-11/h7-8H,4-6H2,1-3H3,(H2,12,13,14)
InChIKeyVDQQAGMXJGNCKR-UHFFFAOYSA-N
MW209.29 g/mol
LogP2.19
Rot. Bonds5

About 5-ethyl-6-pentan-2-yloxypyrimidin-4-amine

5-ethyl-6-pentan-2-yloxypyrimidin-4-amine (PubChem CID 102989268) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is 5-ethyl-6-pentan-2-yloxypyrimidin-4-amine.

Molecular Properties

Compound Name5-ethyl-6-pentan-2-yloxypyrimidin-4-amine
PubChem CID102989268
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name5-ethyl-6-pentan-2-yloxypyrimidin-4-amine
SMILESCCCC(C)Oc1ncnc(N)c1CC
InChIInChI=1S/C11H19N3O/c1-4-6-8(3)15-11-9(5-2)10(12)13-7-14-11/h7-8H,4-6H2,1-3H3,(H2,12,13,14)
InChIKeyVDQQAGMXJGNCKR-UHFFFAOYSA-N
XLogP2.19
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-6-pentan-2-yloxypyrimidin-4-amine?
The IUPAC name of 5-ethyl-6-pentan-2-yloxypyrimidin-4-amine (CID 102989268) is 5-ethyl-6-pentan-2-yloxypyrimidin-4-amine.
What is the SMILES notation for 5-ethyl-6-pentan-2-yloxypyrimidin-4-amine?
The canonical SMILES for 5-ethyl-6-pentan-2-yloxypyrimidin-4-amine is CCCC(C)Oc1ncnc(N)c1CC.
What is the InChIKey of 5-ethyl-6-pentan-2-yloxypyrimidin-4-amine?
The InChIKey is VDQQAGMXJGNCKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-4-6-8(3)15-11-9(5-2)10(12)13-7-14-11/h7-8H,4-6H2,1-3H3,(H2,12,13,14).
What are the key properties of 5-ethyl-6-pentan-2-yloxypyrimidin-4-amine?
5-ethyl-6-pentan-2-yloxypyrimidin-4-amine has a molecular weight of 209.29 g/mol, XLogP of 2.19, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-6-pentan-2-yloxypyrimidin-4-amine is sourced from PubChem (CID 102989268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).