N-ethyl-2,5-dimethyl-6-(2,3,5-trimethylpiperidin-1-yl)pyrimidin-4-amine

C16H28N4 — CID 114597881

IUPACN-ethyl-2,5-dimethyl-6-(2,3,5-trimethylpiperidin-1-yl)pyrimidin-4-amine
SMILESCCNc1nc(C)nc(N2CC(C)CC(C)C2C)c1C
InChIInChI=1S/C16H28N4/c1-7-17-15-12(4)16(19-14(6)18-15)20-9-10(2)8-11(3)13(20)5/h10-11,13H,7-9H2,1-6H3,(H,17,18,19)
InChIKeyPXSLZZYJYNIAPV-UHFFFAOYSA-N
MW276.43 g/mol
LogP3.40
Rot. Bonds3

About N-ethyl-2,5-dimethyl-6-(2,3,5-trimethylpiperidin-1-yl)pyrimidin-4-amine

N-ethyl-2,5-dimethyl-6-(2,3,5-trimethylpiperidin-1-yl)pyrimidin-4-amine (PubChem CID 114597881) has the molecular formula C16H28N4 and a molecular weight of 276.43 g/mol. Its IUPAC name is N-ethyl-2,5-dimethyl-6-(2,3,5-trimethylpiperidin-1-yl)pyrimidin-4-amine.

Molecular Properties

Compound NameN-ethyl-2,5-dimethyl-6-(2,3,5-trimethylpiperidin-1-yl)pyrimidin-4-amine
PubChem CID114597881
Molecular FormulaC16H28N4
Molecular Weight276.43 g/mol
Exact Mass276.23
IUPAC NameN-ethyl-2,5-dimethyl-6-(2,3,5-trimethylpiperidin-1-yl)pyrimidin-4-amine
SMILESCCNc1nc(C)nc(N2CC(C)CC(C)C2C)c1C
InChIInChI=1S/C16H28N4/c1-7-17-15-12(4)16(19-14(6)18-15)20-9-10(2)8-11(3)13(20)5/h10-11,13H,7-9H2,1-6H3,(H,17,18,19)
InChIKeyPXSLZZYJYNIAPV-UHFFFAOYSA-N
XLogP3.40
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
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

[2,5-dimethyl-6-(2,3,5-trimethylpiperidin-1-yl)pyrimidin-4-yl]hydrazine
CID 114597979
N-ethyl-2,5-dimethyl-6-(3-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)pyrimidin-4-amine
CID 80838425
N-ethyl-6-(2-ethylazepan-1-yl)-2,5-dimethylpyrimidin-4-amine
CID 104693040
6-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-N-ethyl-2,5-dimethylpyrimidin-4-amine
CID 80824999
2,5-dimethyl-6-(3-methylthiomorpholin-4-yl)-N-propylpyrimidin-4-amine
CID 80836387
[1-[6-(ethylamino)-2,5-dimethylpyrimidin-4-yl]azepan-2-yl]methanol
CID 116640740
1-[6-(ethylamino)-2,5-dimethylpyrimidin-4-yl]piperidin-4-ol
CID 80764591
6-(2,4-dimethylpiperidin-1-yl)-N,2-diethyl-5-methylpyrimidin-4-amine
CID 80982600
N-ethyl-8-(2,3,5-trimethylpiperidin-1-yl)imidazo[1,2-a]pyrazin-6-amine
CID 114597910
[1-[6-(ethylamino)-2,5-dimethylpyrimidin-4-yl]pyrrolidin-3-yl]methanol
CID 112629574
1-[6-(ethylamino)-2,5-dimethylpyrimidin-4-yl]-N-methylpyrrolidine-2-carboxamide
CID 80805785
4-N-ethyl-6-(2,3,5-trimethylpiperidin-1-yl)pyrimidine-2,4-diamine
CID 114597917

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2,5-dimethyl-6-(2,3,5-trimethylpiperidin-1-yl)pyrimidin-4-amine?
The IUPAC name of N-ethyl-2,5-dimethyl-6-(2,3,5-trimethylpiperidin-1-yl)pyrimidin-4-amine (CID 114597881) is N-ethyl-2,5-dimethyl-6-(2,3,5-trimethylpiperidin-1-yl)pyrimidin-4-amine.
What is the SMILES notation for N-ethyl-2,5-dimethyl-6-(2,3,5-trimethylpiperidin-1-yl)pyrimidin-4-amine?
The canonical SMILES for N-ethyl-2,5-dimethyl-6-(2,3,5-trimethylpiperidin-1-yl)pyrimidin-4-amine is CCNc1nc(C)nc(N2CC(C)CC(C)C2C)c1C.
What is the InChIKey of N-ethyl-2,5-dimethyl-6-(2,3,5-trimethylpiperidin-1-yl)pyrimidin-4-amine?
The InChIKey is PXSLZZYJYNIAPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N4/c1-7-17-15-12(4)16(19-14(6)18-15)20-9-10(2)8-11(3)13(20)5/h10-11,13H,7-9H2,1-6H3,(H,17,18,19).
What are the key properties of N-ethyl-2,5-dimethyl-6-(2,3,5-trimethylpiperidin-1-yl)pyrimidin-4-amine?
N-ethyl-2,5-dimethyl-6-(2,3,5-trimethylpiperidin-1-yl)pyrimidin-4-amine has a molecular weight of 276.43 g/mol, XLogP of 3.40, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2,5-dimethyl-6-(2,3,5-trimethylpiperidin-1-yl)pyrimidin-4-amine is sourced from PubChem (CID 114597881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).