6-(3,4-dimethylpiperazin-1-yl)-2-ethyl-N,5-dimethylpyrimidin-4-amine

C14H25N5 — CID 80984292

IUPAC6-(3,4-dimethylpiperazin-1-yl)-2-ethyl-N,5-dimethylpyrimidin-4-amine
SMILESCCc1nc(NC)c(C)c(N2CCN(C)C(C)C2)n1
InChIInChI=1S/C14H25N5/c1-6-12-16-13(15-4)11(3)14(17-12)19-8-7-18(5)10(2)9-19/h10H,6-9H2,1-5H3,(H,15,16,17)
InChIKeyXUUAXAZYOQBSKR-UHFFFAOYSA-N
MW263.39 g/mol
LogP1.53
Rot. Bonds3

About 6-(3,4-dimethylpiperazin-1-yl)-2-ethyl-N,5-dimethylpyrimidin-4-amine

6-(3,4-dimethylpiperazin-1-yl)-2-ethyl-N,5-dimethylpyrimidin-4-amine (PubChem CID 80984292) has the molecular formula C14H25N5 and a molecular weight of 263.39 g/mol. Its IUPAC name is 6-(3,4-dimethylpiperazin-1-yl)-2-ethyl-N,5-dimethylpyrimidin-4-amine.

Molecular Properties

Compound Name6-(3,4-dimethylpiperazin-1-yl)-2-ethyl-N,5-dimethylpyrimidin-4-amine
PubChem CID80984292
Molecular FormulaC14H25N5
Molecular Weight263.39 g/mol
Exact Mass263.21
IUPAC Name6-(3,4-dimethylpiperazin-1-yl)-2-ethyl-N,5-dimethylpyrimidin-4-amine
SMILESCCc1nc(NC)c(C)c(N2CCN(C)C(C)C2)n1
InChIInChI=1S/C14H25N5/c1-6-12-16-13(15-4)11(3)14(17-12)19-8-7-18(5)10(2)9-19/h10H,6-9H2,1-5H3,(H,15,16,17)
InChIKeyXUUAXAZYOQBSKR-UHFFFAOYSA-N
XLogP1.53
TPSA44.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.39
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-[2-ethyl-5-methyl-6-(methylamino)pyrimidin-4-yl]piperidin-3-ol
CID 80993142
2-ethyl-N,5-dimethyl-6-piperazin-1-ylpyrimidin-4-amine
CID 80983428
6-[4-(dimethylamino)piperidin-1-yl]-2-ethyl-N,5-dimethylpyrimidin-4-amine
CID 80993261
6-(4-butan-2-ylpiperazin-1-yl)-2-ethyl-N,5-dimethylpyrimidin-4-amine
CID 80985404
2-ethyl-N,5-dimethyl-6-(2-methylpiperidin-1-yl)pyrimidin-4-amine
CID 80981348
6-(2,5-dimethylpiperidin-1-yl)-2-ethyl-N,5-dimethylpyrimidin-4-amine
CID 80991992
6-(2-cyclopentylpyrrolidin-1-yl)-2-ethyl-N,5-dimethylpyrimidin-4-amine
CID 80984251
2-cyclopropyl-6-(3-ethyl-4-methylpiperazin-1-yl)-N,5-dimethylpyrimidin-4-amine
CID 80983840
6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N,5-dimethyl-2-propylpyrimidin-4-amine
CID 104961762
[4-[2-ethyl-5-methyl-6-(methylamino)pyrimidin-4-yl]-6,6-dimethylmorpholin-2-yl]methanol
CID 114782647
1-[2-ethyl-6-(ethylamino)-5-methylpyrimidin-4-yl]-3-methylpiperidin-4-ol
CID 114683955
1-(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)pyrrolidin-3-ol
CID 81006896

Frequently Asked Questions

What is the IUPAC name of 6-(3,4-dimethylpiperazin-1-yl)-2-ethyl-N,5-dimethylpyrimidin-4-amine?
The IUPAC name of 6-(3,4-dimethylpiperazin-1-yl)-2-ethyl-N,5-dimethylpyrimidin-4-amine (CID 80984292) is 6-(3,4-dimethylpiperazin-1-yl)-2-ethyl-N,5-dimethylpyrimidin-4-amine.
What is the SMILES notation for 6-(3,4-dimethylpiperazin-1-yl)-2-ethyl-N,5-dimethylpyrimidin-4-amine?
The canonical SMILES for 6-(3,4-dimethylpiperazin-1-yl)-2-ethyl-N,5-dimethylpyrimidin-4-amine is CCc1nc(NC)c(C)c(N2CCN(C)C(C)C2)n1.
What is the InChIKey of 6-(3,4-dimethylpiperazin-1-yl)-2-ethyl-N,5-dimethylpyrimidin-4-amine?
The InChIKey is XUUAXAZYOQBSKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N5/c1-6-12-16-13(15-4)11(3)14(17-12)19-8-7-18(5)10(2)9-19/h10H,6-9H2,1-5H3,(H,15,16,17).
What are the key properties of 6-(3,4-dimethylpiperazin-1-yl)-2-ethyl-N,5-dimethylpyrimidin-4-amine?
6-(3,4-dimethylpiperazin-1-yl)-2-ethyl-N,5-dimethylpyrimidin-4-amine has a molecular weight of 263.39 g/mol, XLogP of 1.53, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3,4-dimethylpiperazin-1-yl)-2-ethyl-N,5-dimethylpyrimidin-4-amine is sourced from PubChem (CID 80984292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).