2-ethyl-N-methyl-6-piperidin-1-ylpyrimidin-4-amine

C12H20N4 — CID 80934171

IUPAC2-ethyl-N-methyl-6-piperidin-1-ylpyrimidin-4-amine
SMILESCCc1nc(NC)cc(N2CCCCC2)n1
InChIInChI=1S/C12H20N4/c1-3-10-14-11(13-2)9-12(15-10)16-7-5-4-6-8-16/h9H,3-8H2,1-2H3,(H,13,14,15)
InChIKeyWFRVCXBBMUAPCF-UHFFFAOYSA-N
MW220.32 g/mol
LogP2.07
Rot. Bonds3

About 2-ethyl-N-methyl-6-piperidin-1-ylpyrimidin-4-amine

2-ethyl-N-methyl-6-piperidin-1-ylpyrimidin-4-amine (PubChem CID 80934171) has the molecular formula C12H20N4 and a molecular weight of 220.32 g/mol. Its IUPAC name is 2-ethyl-N-methyl-6-piperidin-1-ylpyrimidin-4-amine.

Molecular Properties

Compound Name2-ethyl-N-methyl-6-piperidin-1-ylpyrimidin-4-amine
PubChem CID80934171
Molecular FormulaC12H20N4
Molecular Weight220.32 g/mol
Exact Mass220.17
IUPAC Name2-ethyl-N-methyl-6-piperidin-1-ylpyrimidin-4-amine
SMILESCCc1nc(NC)cc(N2CCCCC2)n1
InChIInChI=1S/C12H20N4/c1-3-10-14-11(13-2)9-12(15-10)16-7-5-4-6-8-16/h9H,3-8H2,1-2H3,(H,13,14,15)
InChIKeyWFRVCXBBMUAPCF-UHFFFAOYSA-N
XLogP2.07
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-methyl-6-piperidin-1-ylpyrimidin-4-amine?
The IUPAC name of 2-ethyl-N-methyl-6-piperidin-1-ylpyrimidin-4-amine (CID 80934171) is 2-ethyl-N-methyl-6-piperidin-1-ylpyrimidin-4-amine.
What is the SMILES notation for 2-ethyl-N-methyl-6-piperidin-1-ylpyrimidin-4-amine?
The canonical SMILES for 2-ethyl-N-methyl-6-piperidin-1-ylpyrimidin-4-amine is CCc1nc(NC)cc(N2CCCCC2)n1.
What is the InChIKey of 2-ethyl-N-methyl-6-piperidin-1-ylpyrimidin-4-amine?
The InChIKey is WFRVCXBBMUAPCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4/c1-3-10-14-11(13-2)9-12(15-10)16-7-5-4-6-8-16/h9H,3-8H2,1-2H3,(H,13,14,15).
What are the key properties of 2-ethyl-N-methyl-6-piperidin-1-ylpyrimidin-4-amine?
2-ethyl-N-methyl-6-piperidin-1-ylpyrimidin-4-amine has a molecular weight of 220.32 g/mol, XLogP of 2.07, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-methyl-6-piperidin-1-ylpyrimidin-4-amine is sourced from PubChem (CID 80934171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).