2-ethyl-6-methyl-N-piperidin-4-ylpyrimidin-4-amine

C12H20N4 — CID 94075343

IUPAC2-ethyl-6-methyl-N-piperidin-4-ylpyrimidin-4-amine
SMILESCCc1nc(C)cc(NC2CCNCC2)n1
InChIInChI=1S/C12H20N4/c1-3-11-14-9(2)8-12(16-11)15-10-4-6-13-7-5-10/h8,10,13H,3-7H2,1-2H3,(H,14,15,16)
InChIKeyRKJIBAVGCLGJPU-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.51
Rot. Bonds3

About 2-ethyl-6-methyl-N-piperidin-4-ylpyrimidin-4-amine

2-ethyl-6-methyl-N-piperidin-4-ylpyrimidin-4-amine (PubChem CID 94075343) has the molecular formula C12H20N4 and a molecular weight of 220.32 g/mol. Its IUPAC name is 2-ethyl-6-methyl-N-piperidin-4-ylpyrimidin-4-amine.

Molecular Properties

Compound Name2-ethyl-6-methyl-N-piperidin-4-ylpyrimidin-4-amine
PubChem CID94075343
Molecular FormulaC12H20N4
Molecular Weight220.32 g/mol
Exact Mass220.17
IUPAC Name2-ethyl-6-methyl-N-piperidin-4-ylpyrimidin-4-amine
SMILESCCc1nc(C)cc(NC2CCNCC2)n1
InChIInChI=1S/C12H20N4/c1-3-11-14-9(2)8-12(16-11)15-10-4-6-13-7-5-10/h8,10,13H,3-7H2,1-2H3,(H,14,15,16)
InChIKeyRKJIBAVGCLGJPU-UHFFFAOYSA-N
XLogP1.51
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-6-methyl-N-piperidin-4-ylpyrimidin-4-amine?
The IUPAC name of 2-ethyl-6-methyl-N-piperidin-4-ylpyrimidin-4-amine (CID 94075343) is 2-ethyl-6-methyl-N-piperidin-4-ylpyrimidin-4-amine.
What is the SMILES notation for 2-ethyl-6-methyl-N-piperidin-4-ylpyrimidin-4-amine?
The canonical SMILES for 2-ethyl-6-methyl-N-piperidin-4-ylpyrimidin-4-amine is CCc1nc(C)cc(NC2CCNCC2)n1.
What is the InChIKey of 2-ethyl-6-methyl-N-piperidin-4-ylpyrimidin-4-amine?
The InChIKey is RKJIBAVGCLGJPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4/c1-3-11-14-9(2)8-12(16-11)15-10-4-6-13-7-5-10/h8,10,13H,3-7H2,1-2H3,(H,14,15,16).
What are the key properties of 2-ethyl-6-methyl-N-piperidin-4-ylpyrimidin-4-amine?
2-ethyl-6-methyl-N-piperidin-4-ylpyrimidin-4-amine has a molecular weight of 220.32 g/mol, XLogP of 1.51, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-6-methyl-N-piperidin-4-ylpyrimidin-4-amine is sourced from PubChem (CID 94075343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).