6-(2,5-dimethylpiperidin-1-yl)-5-propan-2-ylpyrimidin-4-amine

C14H24N4 — CID 80846958

IUPAC6-(2,5-dimethylpiperidin-1-yl)-5-propan-2-ylpyrimidin-4-amine
SMILESCC1CCC(C)N(c2ncnc(N)c2C(C)C)C1
InChIInChI=1S/C14H24N4/c1-9(2)12-13(15)16-8-17-14(12)18-7-10(3)5-6-11(18)4/h8-11H,5-7H2,1-4H3,(H2,15,16,17)
InChIKeyIQMUZKBRWPUAOW-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.81
Rot. Bonds2

About 6-(2,5-dimethylpiperidin-1-yl)-5-propan-2-ylpyrimidin-4-amine

6-(2,5-dimethylpiperidin-1-yl)-5-propan-2-ylpyrimidin-4-amine (PubChem CID 80846958) has the molecular formula C14H24N4 and a molecular weight of 248.37 g/mol. Its IUPAC name is 6-(2,5-dimethylpiperidin-1-yl)-5-propan-2-ylpyrimidin-4-amine.

Molecular Properties

Compound Name6-(2,5-dimethylpiperidin-1-yl)-5-propan-2-ylpyrimidin-4-amine
PubChem CID80846958
Molecular FormulaC14H24N4
Molecular Weight248.37 g/mol
Exact Mass248.20
IUPAC Name6-(2,5-dimethylpiperidin-1-yl)-5-propan-2-ylpyrimidin-4-amine
SMILESCC1CCC(C)N(c2ncnc(N)c2C(C)C)C1
InChIInChI=1S/C14H24N4/c1-9(2)12-13(15)16-8-17-14(12)18-7-10(3)5-6-11(18)4/h8-11H,5-7H2,1-4H3,(H2,15,16,17)
InChIKeyIQMUZKBRWPUAOW-UHFFFAOYSA-N
XLogP2.81
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(2,5-dimethylpiperidin-1-yl)-5-propan-2-ylpyrimidin-4-amine?
The IUPAC name of 6-(2,5-dimethylpiperidin-1-yl)-5-propan-2-ylpyrimidin-4-amine (CID 80846958) is 6-(2,5-dimethylpiperidin-1-yl)-5-propan-2-ylpyrimidin-4-amine.
What is the SMILES notation for 6-(2,5-dimethylpiperidin-1-yl)-5-propan-2-ylpyrimidin-4-amine?
The canonical SMILES for 6-(2,5-dimethylpiperidin-1-yl)-5-propan-2-ylpyrimidin-4-amine is CC1CCC(C)N(c2ncnc(N)c2C(C)C)C1.
What is the InChIKey of 6-(2,5-dimethylpiperidin-1-yl)-5-propan-2-ylpyrimidin-4-amine?
The InChIKey is IQMUZKBRWPUAOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4/c1-9(2)12-13(15)16-8-17-14(12)18-7-10(3)5-6-11(18)4/h8-11H,5-7H2,1-4H3,(H2,15,16,17).
What are the key properties of 6-(2,5-dimethylpiperidin-1-yl)-5-propan-2-ylpyrimidin-4-amine?
6-(2,5-dimethylpiperidin-1-yl)-5-propan-2-ylpyrimidin-4-amine has a molecular weight of 248.37 g/mol, XLogP of 2.81, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,5-dimethylpiperidin-1-yl)-5-propan-2-ylpyrimidin-4-amine is sourced from PubChem (CID 80846958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).