4-ethyl-6-(2-ethylpiperazin-1-yl)pyrimidine

C12H20N4 — CID 63600778

IUPAC4-ethyl-6-(2-ethylpiperazin-1-yl)pyrimidine
SMILESCCc1cc(N2CCNCC2CC)ncn1
InChIInChI=1S/C12H20N4/c1-3-10-7-12(15-9-14-10)16-6-5-13-8-11(16)4-2/h7,9,11,13H,3-6,8H2,1-2H3
InChIKeyXJDXYFBAEQJUES-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.23
Rot. Bonds3

About 4-ethyl-6-(2-ethylpiperazin-1-yl)pyrimidine

4-ethyl-6-(2-ethylpiperazin-1-yl)pyrimidine (PubChem CID 63600778) has the molecular formula C12H20N4 and a molecular weight of 220.32 g/mol. Its IUPAC name is 4-ethyl-6-(2-ethylpiperazin-1-yl)pyrimidine.

Molecular Properties

Compound Name4-ethyl-6-(2-ethylpiperazin-1-yl)pyrimidine
PubChem CID63600778
Molecular FormulaC12H20N4
Molecular Weight220.32 g/mol
Exact Mass220.17
IUPAC Name4-ethyl-6-(2-ethylpiperazin-1-yl)pyrimidine
SMILESCCc1cc(N2CCNCC2CC)ncn1
InChIInChI=1S/C12H20N4/c1-3-10-7-12(15-9-14-10)16-6-5-13-8-11(16)4-2/h7,9,11,13H,3-6,8H2,1-2H3
InChIKeyXJDXYFBAEQJUES-UHFFFAOYSA-N
XLogP1.23
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 ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-ethyl-1-pyridin-2-ylpiperazine
CID 63600435
4-(2-ethylpiperazin-1-yl)-6-methoxy-5-methylpyrimidine
CID 66327162
4-[(2R)-2-methylpiperazin-1-yl]-6-(2,2,2-trifluoroethyl)pyrimidine
CID 126848956
[1-(6-ethylpyrimidin-4-yl)azepan-2-yl]methanol
CID 116636939
4-[2-(2-bromoethyl)piperidin-1-yl]-6-ethylpyrimidine
CID 80670776
N-[[1-(6-ethylpyrimidin-4-yl)pyrrolidin-2-yl]methyl]cyclopropanamine
CID 62591990
N-[[1-(6-ethylpyrimidin-4-yl)pyrrolidin-2-yl]methyl]-2-methylpropan-1-amine
CID 55091054
5-(2-ethylpiperazin-1-yl)-3-methyl-1,2-oxazole
CID 82670184
2-ethyl-1-(2-methyl-3-pyridinyl)piperazine
CID 79044286
3-[1-(6-ethylpyrimidin-4-yl)piperidin-2-yl]propanoic acid
CID 62216304
2-ethyl-1-(4-iodophenyl)piperazine
CID 64931488
1-(4-bromo-2-ethylphenyl)-2-ethylpiperazine
CID 81287006

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-6-(2-ethylpiperazin-1-yl)pyrimidine?
The IUPAC name of 4-ethyl-6-(2-ethylpiperazin-1-yl)pyrimidine (CID 63600778) is 4-ethyl-6-(2-ethylpiperazin-1-yl)pyrimidine.
What is the SMILES notation for 4-ethyl-6-(2-ethylpiperazin-1-yl)pyrimidine?
The canonical SMILES for 4-ethyl-6-(2-ethylpiperazin-1-yl)pyrimidine is CCc1cc(N2CCNCC2CC)ncn1.
What is the InChIKey of 4-ethyl-6-(2-ethylpiperazin-1-yl)pyrimidine?
The InChIKey is XJDXYFBAEQJUES-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4/c1-3-10-7-12(15-9-14-10)16-6-5-13-8-11(16)4-2/h7,9,11,13H,3-6,8H2,1-2H3.
What are the key properties of 4-ethyl-6-(2-ethylpiperazin-1-yl)pyrimidine?
4-ethyl-6-(2-ethylpiperazin-1-yl)pyrimidine has a molecular weight of 220.32 g/mol, XLogP of 1.23, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-6-(2-ethylpiperazin-1-yl)pyrimidine is sourced from PubChem (CID 63600778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).