4-ethoxy-6-(2,3,5-trimethylpiperidin-1-yl)pyrimidin-5-amine

C14H24N4O — CID 114591978

IUPAC4-ethoxy-6-(2,3,5-trimethylpiperidin-1-yl)pyrimidin-5-amine
SMILESCCOc1ncnc(N2CC(C)CC(C)C2C)c1N
InChIInChI=1S/C14H24N4O/c1-5-19-14-12(15)13(16-8-17-14)18-7-9(2)6-10(3)11(18)4/h8-11H,5-7,15H2,1-4H3
InChIKeySYIQJJBUJNCFRB-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.33
Rot. Bonds3

About 4-ethoxy-6-(2,3,5-trimethylpiperidin-1-yl)pyrimidin-5-amine

4-ethoxy-6-(2,3,5-trimethylpiperidin-1-yl)pyrimidin-5-amine (PubChem CID 114591978) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is 4-ethoxy-6-(2,3,5-trimethylpiperidin-1-yl)pyrimidin-5-amine.

Molecular Properties

Compound Name4-ethoxy-6-(2,3,5-trimethylpiperidin-1-yl)pyrimidin-5-amine
PubChem CID114591978
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC Name4-ethoxy-6-(2,3,5-trimethylpiperidin-1-yl)pyrimidin-5-amine
SMILESCCOc1ncnc(N2CC(C)CC(C)C2C)c1N
InChIInChI=1S/C14H24N4O/c1-5-19-14-12(15)13(16-8-17-14)18-7-9(2)6-10(3)11(18)4/h8-11H,5-7,15H2,1-4H3
InChIKeySYIQJJBUJNCFRB-UHFFFAOYSA-N
XLogP2.33
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-6-(2,3,5-trimethylpiperidin-1-yl)pyrimidin-5-amine?
The IUPAC name of 4-ethoxy-6-(2,3,5-trimethylpiperidin-1-yl)pyrimidin-5-amine (CID 114591978) is 4-ethoxy-6-(2,3,5-trimethylpiperidin-1-yl)pyrimidin-5-amine.
What is the SMILES notation for 4-ethoxy-6-(2,3,5-trimethylpiperidin-1-yl)pyrimidin-5-amine?
The canonical SMILES for 4-ethoxy-6-(2,3,5-trimethylpiperidin-1-yl)pyrimidin-5-amine is CCOc1ncnc(N2CC(C)CC(C)C2C)c1N.
What is the InChIKey of 4-ethoxy-6-(2,3,5-trimethylpiperidin-1-yl)pyrimidin-5-amine?
The InChIKey is SYIQJJBUJNCFRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-5-19-14-12(15)13(16-8-17-14)18-7-9(2)6-10(3)11(18)4/h8-11H,5-7,15H2,1-4H3.
What are the key properties of 4-ethoxy-6-(2,3,5-trimethylpiperidin-1-yl)pyrimidin-5-amine?
4-ethoxy-6-(2,3,5-trimethylpiperidin-1-yl)pyrimidin-5-amine has a molecular weight of 264.37 g/mol, XLogP of 2.33, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-6-(2,3,5-trimethylpiperidin-1-yl)pyrimidin-5-amine is sourced from PubChem (CID 114591978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).