2-ethyl-5-methyl-1-[2-(2-methylimidazol-1-yl)ethyl]piperazine

C13H24N4 — CID 64847055

IUPAC2-ethyl-5-methyl-1-[2-(2-methylimidazol-1-yl)ethyl]piperazine
SMILESCCC1CNC(C)CN1CCn1ccnc1C
InChIInChI=1S/C13H24N4/c1-4-13-9-15-11(2)10-17(13)8-7-16-6-5-14-12(16)3/h5-6,11,13,15H,4,7-10H2,1-3H3
InChIKeyXDHSXODDMCUKMU-UHFFFAOYSA-N
MW236.36 g/mol
LogP1.26
Rot. Bonds4

About 2-ethyl-5-methyl-1-[2-(2-methylimidazol-1-yl)ethyl]piperazine

2-ethyl-5-methyl-1-[2-(2-methylimidazol-1-yl)ethyl]piperazine (PubChem CID 64847055) has the molecular formula C13H24N4 and a molecular weight of 236.36 g/mol. Its IUPAC name is 2-ethyl-5-methyl-1-[2-(2-methylimidazol-1-yl)ethyl]piperazine.

Molecular Properties

Compound Name2-ethyl-5-methyl-1-[2-(2-methylimidazol-1-yl)ethyl]piperazine
PubChem CID64847055
Molecular FormulaC13H24N4
Molecular Weight236.36 g/mol
Exact Mass236.20
IUPAC Name2-ethyl-5-methyl-1-[2-(2-methylimidazol-1-yl)ethyl]piperazine
SMILESCCC1CNC(C)CN1CCn1ccnc1C
InChIInChI=1S/C13H24N4/c1-4-13-9-15-11(2)10-17(13)8-7-16-6-5-14-12(16)3/h5-6,11,13,15H,4,7-10H2,1-3H3
InChIKeyXDHSXODDMCUKMU-UHFFFAOYSA-N
XLogP1.26
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-ethyl-1-[2-(2-methylimidazol-1-yl)ethyl]-5-(2-methylpropyl)piperazine
CID 64849690
2-butan-2-yl-5-ethyl-1-[2-(2-methylimidazol-1-yl)ethyl]piperazine
CID 64841937
2-methyl-1-[2-(2-methylimidazol-1-yl)ethyl]-5-phenylpiperazine
CID 64876301
1-[2-(2-methylimidazol-1-yl)ethyl]-2-propan-2-yl-5-propylpiperazine
CID 64839360
2-ethyl-1-(3-fluoropropyl)-5-methylpiperazine
CID 81112995
2-ethyl-5-methyl-1-[(4-methyl-3-pyridinyl)methyl]piperazine
CID 114957684
2-ethyl-5-methyl-1-[(1-methyltriazol-4-yl)methyl]piperazine
CID 107055406
3-(2-ethyl-5-methylpiperazin-1-yl)-N,N-dimethylpropan-1-amine
CID 64936336
2-ethyl-5-methyl-1-(2-phenylsulfanylethyl)piperazine
CID 79224352
5-cyclopropyl-5-methyl-1-[2-(2-methylimidazol-1-yl)ethyl]-2-propylpiperazine
CID 64876913
2-ethyl-1-(4-methoxybutyl)-5-methylpiperazine
CID 64939101
5-methyl-2-(2-methylpropyl)-1-(2-pyrazol-1-ylethyl)piperazine
CID 64845781

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-5-methyl-1-[2-(2-methylimidazol-1-yl)ethyl]piperazine?
The IUPAC name of 2-ethyl-5-methyl-1-[2-(2-methylimidazol-1-yl)ethyl]piperazine (CID 64847055) is 2-ethyl-5-methyl-1-[2-(2-methylimidazol-1-yl)ethyl]piperazine.
What is the SMILES notation for 2-ethyl-5-methyl-1-[2-(2-methylimidazol-1-yl)ethyl]piperazine?
The canonical SMILES for 2-ethyl-5-methyl-1-[2-(2-methylimidazol-1-yl)ethyl]piperazine is CCC1CNC(C)CN1CCn1ccnc1C.
What is the InChIKey of 2-ethyl-5-methyl-1-[2-(2-methylimidazol-1-yl)ethyl]piperazine?
The InChIKey is XDHSXODDMCUKMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4/c1-4-13-9-15-11(2)10-17(13)8-7-16-6-5-14-12(16)3/h5-6,11,13,15H,4,7-10H2,1-3H3.
What are the key properties of 2-ethyl-5-methyl-1-[2-(2-methylimidazol-1-yl)ethyl]piperazine?
2-ethyl-5-methyl-1-[2-(2-methylimidazol-1-yl)ethyl]piperazine has a molecular weight of 236.36 g/mol, XLogP of 1.26, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-5-methyl-1-[2-(2-methylimidazol-1-yl)ethyl]piperazine is sourced from PubChem (CID 64847055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).