2-ethyl-5-methyl-1-(1-methylpiperidin-4-yl)piperazine

C13H27N3 — CID 64937105

IUPAC2-ethyl-5-methyl-1-(1-methylpiperidin-4-yl)piperazine
SMILESCCC1CNC(C)CN1C1CCN(C)CC1
InChIInChI=1S/C13H27N3/c1-4-12-9-14-11(2)10-16(12)13-5-7-15(3)8-6-13/h11-14H,4-10H2,1-3H3
InChIKeyHUVHACPWBIVYNN-UHFFFAOYSA-N
MW225.38 g/mol
LogP1.15
Rot. Bonds2

About 2-ethyl-5-methyl-1-(1-methylpiperidin-4-yl)piperazine

2-ethyl-5-methyl-1-(1-methylpiperidin-4-yl)piperazine (PubChem CID 64937105) has the molecular formula C13H27N3 and a molecular weight of 225.38 g/mol. Its IUPAC name is 2-ethyl-5-methyl-1-(1-methylpiperidin-4-yl)piperazine.

Molecular Properties

Compound Name2-ethyl-5-methyl-1-(1-methylpiperidin-4-yl)piperazine
PubChem CID64937105
Molecular FormulaC13H27N3
Molecular Weight225.38 g/mol
Exact Mass225.22
IUPAC Name2-ethyl-5-methyl-1-(1-methylpiperidin-4-yl)piperazine
SMILESCCC1CNC(C)CN1C1CCN(C)CC1
InChIInChI=1S/C13H27N3/c1-4-12-9-14-11(2)10-16(12)13-5-7-15(3)8-6-13/h11-14H,4-10H2,1-3H3
InChIKeyHUVHACPWBIVYNN-UHFFFAOYSA-N
XLogP1.15
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-ethyl-5-methyl-1-(4-methylcyclohexyl)piperazine
CID 64954867
5-cyclopropyl-2-ethyl-1-(1-methylpiperidin-4-yl)piperazine
CID 64935586
5-butan-2-yl-2-ethyl-1-(1-methylpiperidin-4-yl)piperazine
CID 64937106
2,5-diethyl-1-(1-methylpyrrolidin-3-yl)piperazine
CID 64977928
2-ethyl-5-methyl-1-(2-methylcyclobutyl)piperazine
CID 130556507
1-cyclopentyl-5-methyl-2-propylpiperazine
CID 82937184
1-(2,3-dimethylcyclopentyl)-2-ethyl-5-methylpiperazine
CID 64938031
2-ethyl-5,5-dimethyl-1-(1-methylpiperidin-4-yl)piperazine
CID 64933663
2,5-diethyl-1-(1-propan-2-ylpiperidin-4-yl)piperazine
CID 64977779
2,5-diethyl-5-methyl-1-(1-methylpiperidin-4-yl)piperazine
CID 64935587
5-cyclopropyl-2-ethyl-1-(1-methylpiperidin-3-yl)piperazine
CID 64935911
1-cyclopropyl-2,5-dimethylpiperazine
CID 64954280

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-5-methyl-1-(1-methylpiperidin-4-yl)piperazine?
The IUPAC name of 2-ethyl-5-methyl-1-(1-methylpiperidin-4-yl)piperazine (CID 64937105) is 2-ethyl-5-methyl-1-(1-methylpiperidin-4-yl)piperazine.
What is the SMILES notation for 2-ethyl-5-methyl-1-(1-methylpiperidin-4-yl)piperazine?
The canonical SMILES for 2-ethyl-5-methyl-1-(1-methylpiperidin-4-yl)piperazine is CCC1CNC(C)CN1C1CCN(C)CC1.
What is the InChIKey of 2-ethyl-5-methyl-1-(1-methylpiperidin-4-yl)piperazine?
The InChIKey is HUVHACPWBIVYNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3/c1-4-12-9-14-11(2)10-16(12)13-5-7-15(3)8-6-13/h11-14H,4-10H2,1-3H3.
What are the key properties of 2-ethyl-5-methyl-1-(1-methylpiperidin-4-yl)piperazine?
2-ethyl-5-methyl-1-(1-methylpiperidin-4-yl)piperazine has a molecular weight of 225.38 g/mol, XLogP of 1.15, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-5-methyl-1-(1-methylpiperidin-4-yl)piperazine is sourced from PubChem (CID 64937105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).