1-(2-ethylpiperazin-1-yl)ethanamine;piperazine

C12H29N5 — CID 174305416

IUPAC1-(2-ethylpiperazin-1-yl)ethanamine;piperazine
SMILESC1CNCCN1.CCC1CNCCN1C(C)N
InChIInChI=1S/C8H19N3.C4H10N2/c1-3-8-6-10-4-5-11(8)7(2)9;1-2-6-4-3-5-1/h7-8,10H,3-6,9H2,1-2H3;5-6H,1-4H2
InChIKeyGTNZLODSACNQFH-UHFFFAOYSA-N
MW243.40 g/mol
LogP-0.85
Rot. Bonds2

About 1-(2-ethylpiperazin-1-yl)ethanamine;piperazine

1-(2-ethylpiperazin-1-yl)ethanamine;piperazine (PubChem CID 174305416) has the molecular formula C12H29N5 and a molecular weight of 243.40 g/mol. Its IUPAC name is 1-(2-ethylpiperazin-1-yl)ethanamine;piperazine.

Molecular Properties

Compound Name1-(2-ethylpiperazin-1-yl)ethanamine;piperazine
PubChem CID174305416
Molecular FormulaC12H29N5
Molecular Weight243.40 g/mol
Exact Mass243.24
IUPAC Name1-(2-ethylpiperazin-1-yl)ethanamine;piperazine
SMILESC1CNCCN1.CCC1CNCCN1C(C)N
InChIInChI=1S/C8H19N3.C4H10N2/c1-3-8-6-10-4-5-11(8)7(2)9;1-2-6-4-3-5-1/h7-8,10H,3-6,9H2,1-2H3;5-6H,1-4H2
InChIKeyGTNZLODSACNQFH-UHFFFAOYSA-N
XLogP-0.85
TPSA65.35 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.40
LogP ≤ 5-0.85
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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Related Compounds

(2R)-2-ethyl-1-propan-2-ylpiperazine
CID 51627942
2-ethyl-1-propan-2-ylpiperazine;hydrochloride
CID 174972319
(2R)-2-ethyl-1-propan-2-ylpiperazine;hydrochloride
CID 141432719
2-ethyl-1-pentan-2-ylpiperazine
CID 64938053
2-ethyl-1-(1,2,2-trifluoroethyl)piperazine
CID 174972427
1-(1-cyclopentylethyl)-2-ethylpiperazine
CID 64932721
1-[1-(1-adamantyl)ethyl]-2-ethylpiperazine
CID 64938236
2-ethyl-1-(1-methoxybutan-2-yl)piperazine
CID 64931133
(1-pentan-2-ylpiperazin-2-yl)methanamine
CID 107895649
2-ethyl-1-[1-(5-methylthiophen-2-yl)ethyl]piperazine
CID 64930896
2-[1-(2-ethylpiperazin-1-yl)ethyl]-1,3-thiazole
CID 64932333
(2S)-1-[(2S)-2-ethylpiperazin-1-yl]propan-2-ol
CID 98219220

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethylpiperazin-1-yl)ethanamine;piperazine?
The IUPAC name of 1-(2-ethylpiperazin-1-yl)ethanamine;piperazine (CID 174305416) is 1-(2-ethylpiperazin-1-yl)ethanamine;piperazine.
What is the SMILES notation for 1-(2-ethylpiperazin-1-yl)ethanamine;piperazine?
The canonical SMILES for 1-(2-ethylpiperazin-1-yl)ethanamine;piperazine is C1CNCCN1.CCC1CNCCN1C(C)N.
What is the InChIKey of 1-(2-ethylpiperazin-1-yl)ethanamine;piperazine?
The InChIKey is GTNZLODSACNQFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19N3.C4H10N2/c1-3-8-6-10-4-5-11(8)7(2)9;1-2-6-4-3-5-1/h7-8,10H,3-6,9H2,1-2H3;5-6H,1-4H2.
What are the key properties of 1-(2-ethylpiperazin-1-yl)ethanamine;piperazine?
1-(2-ethylpiperazin-1-yl)ethanamine;piperazine has a molecular weight of 243.40 g/mol, XLogP of -0.85, 2 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethylpiperazin-1-yl)ethanamine;piperazine is sourced from PubChem (CID 174305416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).