6-(2,4-dimethylpiperidin-1-yl)-N,2-diethyl-5-methylpyrimidin-4-amine

C16H28N4 — CID 80982600

IUPAC6-(2,4-dimethylpiperidin-1-yl)-N,2-diethyl-5-methylpyrimidin-4-amine
SMILESCCNc1nc(CC)nc(N2CCC(C)CC2C)c1C
InChIInChI=1S/C16H28N4/c1-6-14-18-15(17-7-2)13(5)16(19-14)20-9-8-11(3)10-12(20)4/h11-12H,6-10H2,1-5H3,(H,17,18,19)
InChIKeyJDNCPGMFBGGLOZ-UHFFFAOYSA-N
MW276.43 g/mol
LogP3.40
Rot. Bonds4

About 6-(2,4-dimethylpiperidin-1-yl)-N,2-diethyl-5-methylpyrimidin-4-amine

6-(2,4-dimethylpiperidin-1-yl)-N,2-diethyl-5-methylpyrimidin-4-amine (PubChem CID 80982600) has the molecular formula C16H28N4 and a molecular weight of 276.43 g/mol. Its IUPAC name is 6-(2,4-dimethylpiperidin-1-yl)-N,2-diethyl-5-methylpyrimidin-4-amine.

Molecular Properties

Compound Name6-(2,4-dimethylpiperidin-1-yl)-N,2-diethyl-5-methylpyrimidin-4-amine
PubChem CID80982600
Molecular FormulaC16H28N4
Molecular Weight276.43 g/mol
Exact Mass276.23
IUPAC Name6-(2,4-dimethylpiperidin-1-yl)-N,2-diethyl-5-methylpyrimidin-4-amine
SMILESCCNc1nc(CC)nc(N2CCC(C)CC2C)c1C
InChIInChI=1S/C16H28N4/c1-6-14-18-15(17-7-2)13(5)16(19-14)20-9-8-11(3)10-12(20)4/h11-12H,6-10H2,1-5H3,(H,17,18,19)
InChIKeyJDNCPGMFBGGLOZ-UHFFFAOYSA-N
XLogP3.40
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.43
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N,2-diethyl-5-methyl-6-(3-methylthiomorpholin-4-yl)pyrimidin-4-amine
CID 80985082
N,2-diethyl-5-methyl-6-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)pyrimidin-4-amine
CID 102887630
[1-[2-ethyl-6-(ethylamino)-5-methylpyrimidin-4-yl]pyrrolidin-2-yl]methanol
CID 80987896
6-(2,4-dimethylpiperidin-1-yl)-N,2,5-trimethylpyrimidin-4-amine
CID 80825971
4-chloro-6-(2,4-dimethylpiperidin-1-yl)-5-methyl-2-propylpyrimidine
CID 80971909
2-ethyl-N,5-dimethyl-6-(2-methylpiperidin-1-yl)pyrimidin-4-amine
CID 80981348
8-[2-ethyl-6-(ethylamino)-5-methylpyrimidin-4-yl]-8-azabicyclo[3.2.1]octan-3-ol
CID 80984600
1-[2-ethyl-6-(ethylamino)-5-methylpyrimidin-4-yl]-3-methylpiperidin-4-ol
CID 114683955
6-(2,6-dimethylmorpholin-4-yl)-N,2-diethyl-5-methylpyrimidin-4-amine
CID 80982249
[1-[6-(ethylamino)-5-methyl-2-propylpyrimidin-4-yl]-3-methylpyrrolidin-2-yl]methanol
CID 102789896
6-(2,5-dimethylpiperidin-1-yl)-2-ethyl-N,5-dimethylpyrimidin-4-amine
CID 80991992
N-ethyl-5-methyl-6-(3-methylmorpholin-4-yl)-2-propylpyrimidin-4-amine
CID 80993713

Frequently Asked Questions

What is the IUPAC name of 6-(2,4-dimethylpiperidin-1-yl)-N,2-diethyl-5-methylpyrimidin-4-amine?
The IUPAC name of 6-(2,4-dimethylpiperidin-1-yl)-N,2-diethyl-5-methylpyrimidin-4-amine (CID 80982600) is 6-(2,4-dimethylpiperidin-1-yl)-N,2-diethyl-5-methylpyrimidin-4-amine.
What is the SMILES notation for 6-(2,4-dimethylpiperidin-1-yl)-N,2-diethyl-5-methylpyrimidin-4-amine?
The canonical SMILES for 6-(2,4-dimethylpiperidin-1-yl)-N,2-diethyl-5-methylpyrimidin-4-amine is CCNc1nc(CC)nc(N2CCC(C)CC2C)c1C.
What is the InChIKey of 6-(2,4-dimethylpiperidin-1-yl)-N,2-diethyl-5-methylpyrimidin-4-amine?
The InChIKey is JDNCPGMFBGGLOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N4/c1-6-14-18-15(17-7-2)13(5)16(19-14)20-9-8-11(3)10-12(20)4/h11-12H,6-10H2,1-5H3,(H,17,18,19).
What are the key properties of 6-(2,4-dimethylpiperidin-1-yl)-N,2-diethyl-5-methylpyrimidin-4-amine?
6-(2,4-dimethylpiperidin-1-yl)-N,2-diethyl-5-methylpyrimidin-4-amine has a molecular weight of 276.43 g/mol, XLogP of 3.40, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,4-dimethylpiperidin-1-yl)-N,2-diethyl-5-methylpyrimidin-4-amine is sourced from PubChem (CID 80982600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).