2-(2,5-diethylpiperazin-1-yl)-1-morpholin-4-ylethanone

C14H27N3O2 — CID 64979235

IUPAC2-(2,5-diethylpiperazin-1-yl)-1-morpholin-4-ylethanone
SMILESCCC1CN(CC(=O)N2CCOCC2)C(CC)CN1
InChIInChI=1S/C14H27N3O2/c1-3-12-10-17(13(4-2)9-15-12)11-14(18)16-5-7-19-8-6-16/h12-13,15H,3-11H2,1-2H3
InChIKeyLMAAWWQDYUGDMA-UHFFFAOYSA-N
MW269.39 g/mol
LogP0.31
Rot. Bonds4

About 2-(2,5-diethylpiperazin-1-yl)-1-morpholin-4-ylethanone

2-(2,5-diethylpiperazin-1-yl)-1-morpholin-4-ylethanone (PubChem CID 64979235) has the molecular formula C14H27N3O2 and a molecular weight of 269.39 g/mol. Its IUPAC name is 2-(2,5-diethylpiperazin-1-yl)-1-morpholin-4-ylethanone.

Molecular Properties

Compound Name2-(2,5-diethylpiperazin-1-yl)-1-morpholin-4-ylethanone
PubChem CID64979235
Molecular FormulaC14H27N3O2
Molecular Weight269.39 g/mol
Exact Mass269.21
IUPAC Name2-(2,5-diethylpiperazin-1-yl)-1-morpholin-4-ylethanone
SMILESCCC1CN(CC(=O)N2CCOCC2)C(CC)CN1
InChIInChI=1S/C14H27N3O2/c1-3-12-10-17(13(4-2)9-15-12)11-14(18)16-5-7-19-8-6-16/h12-13,15H,3-11H2,1-2H3
InChIKeyLMAAWWQDYUGDMA-UHFFFAOYSA-N
XLogP0.31
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 50.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2,5-diethylpiperazin-1-yl)-1-morpholin-4-ylethanone?
The IUPAC name of 2-(2,5-diethylpiperazin-1-yl)-1-morpholin-4-ylethanone (CID 64979235) is 2-(2,5-diethylpiperazin-1-yl)-1-morpholin-4-ylethanone.
What is the SMILES notation for 2-(2,5-diethylpiperazin-1-yl)-1-morpholin-4-ylethanone?
The canonical SMILES for 2-(2,5-diethylpiperazin-1-yl)-1-morpholin-4-ylethanone is CCC1CN(CC(=O)N2CCOCC2)C(CC)CN1.
What is the InChIKey of 2-(2,5-diethylpiperazin-1-yl)-1-morpholin-4-ylethanone?
The InChIKey is LMAAWWQDYUGDMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O2/c1-3-12-10-17(13(4-2)9-15-12)11-14(18)16-5-7-19-8-6-16/h12-13,15H,3-11H2,1-2H3.
What are the key properties of 2-(2,5-diethylpiperazin-1-yl)-1-morpholin-4-ylethanone?
2-(2,5-diethylpiperazin-1-yl)-1-morpholin-4-ylethanone has a molecular weight of 269.39 g/mol, XLogP of 0.31, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-diethylpiperazin-1-yl)-1-morpholin-4-ylethanone is sourced from PubChem (CID 64979235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).