2-morpholin-4-yl-1-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]ethanone;dihydrochloride

C16H30Cl2N4O4 — CID 44783828

IUPAC2-morpholin-4-yl-1-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]ethanone;dihydrochloride
SMILESCl.Cl.O=C(CN1CCOCC1)N1CCN(C(=O)CN2CCOCC2)CC1
InChIInChI=1S/C16H28N4O4.2ClH/c21-15(13-17-5-9-23-10-6-17)19-1-2-20(4-3-19)16(22)14-18-7-11-24-12-8-18;;/h1-14H2;2*1H
InChIKeyQWNSOHZHRDHLGE-UHFFFAOYSA-N
MW413.35 g/mol
LogP-0.83
Rot. Bonds4

About 2-morpholin-4-yl-1-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]ethanone;dihydrochloride

2-morpholin-4-yl-1-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]ethanone;dihydrochloride (PubChem CID 44783828) has the molecular formula C16H30Cl2N4O4 and a molecular weight of 413.35 g/mol. Its IUPAC name is 2-morpholin-4-yl-1-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]ethanone;dihydrochloride.

Molecular Properties

Compound Name2-morpholin-4-yl-1-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]ethanone;dihydrochloride
PubChem CID44783828
Molecular FormulaC16H30Cl2N4O4
Molecular Weight413.35 g/mol
Exact Mass412.16
IUPAC Name2-morpholin-4-yl-1-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]ethanone;dihydrochloride
SMILESCl.Cl.O=C(CN1CCOCC1)N1CCN(C(=O)CN2CCOCC2)CC1
InChIInChI=1S/C16H28N4O4.2ClH/c21-15(13-17-5-9-23-10-6-17)19-1-2-20(4-3-19)16(22)14-18-7-11-24-12-8-18;;/h1-14H2;2*1H
InChIKeyQWNSOHZHRDHLGE-UHFFFAOYSA-N
XLogP-0.83
TPSA65.56 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500413.35
LogP ≤ 5-0.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 2-morpholin-4-yl-1-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]ethanone;dihydrochloride with MolForge

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Related Compounds

1,2-Ethanedione, 1,2-di-4-morpholinyl-
CID 240445
1,2-Dimorpholinoethanone
CID 242924
1,4-Bis(morpholinoacetyl)piperazine
CID 265941
Piperidinium, 1,1'-(1,4-piperazinediylbis(carbonylmethylene))bis(1-methyl-, diiodide
CID 121261
Dimorpholinoacetic acid morpholide
CID 129787633
2, 1,4-Bis(4-morpholinylmethyl)-
CID 321251
2-(4-Methylmorpholin-4-ium-4-yl)-1-[4-[2-(4-methylmorpholin-4-ium-4-yl)acetyl]piperazin-1-yl]ethanone
CID 121262
2-(4-Methylmorpholin-4-ium-4-yl)-1-[4-[2-(4-methylmorpholin-4-ium-4-yl)propanoyl]piperazin-1-yl]propan-1-one
CID 199522
3-(4-Methylmorpholin-4-ium-4-yl)-1-[4-[2-(4-methylmorpholin-4-ium-4-yl)acetyl]piperazin-1-yl]propan-1-one
CID 24840364
1-Morpholin-4-yl-2-[4-(2-morpholin-4-yl-2-oxoethyl)-1,4-diazoniabicyclo[2.2.2]octan-1-yl]ethanone
CID 2394973
2-[Methyl-(2-morpholin-4-yl-2-oxoethyl)amino]-1-morpholin-4-ylethanone
CID 58826727
2-(4-Aza-1-azoniabicyclo[2.2.2]octan-1-yl)-1-morpholin-4-ylethanone
CID 141832867

Frequently Asked Questions

What is the IUPAC name of 2-morpholin-4-yl-1-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]ethanone;dihydrochloride?
The IUPAC name of 2-morpholin-4-yl-1-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]ethanone;dihydrochloride (CID 44783828) is 2-morpholin-4-yl-1-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]ethanone;dihydrochloride.
What is the SMILES notation for 2-morpholin-4-yl-1-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]ethanone;dihydrochloride?
The canonical SMILES for 2-morpholin-4-yl-1-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]ethanone;dihydrochloride is Cl.Cl.O=C(CN1CCOCC1)N1CCN(C(=O)CN2CCOCC2)CC1.
What is the InChIKey of 2-morpholin-4-yl-1-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]ethanone;dihydrochloride?
The InChIKey is QWNSOHZHRDHLGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N4O4.2ClH/c21-15(13-17-5-9-23-10-6-17)19-1-2-20(4-3-19)16(22)14-18-7-11-24-12-8-18;;/h1-14H2;2*1H.
What are the key properties of 2-morpholin-4-yl-1-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]ethanone;dihydrochloride?
2-morpholin-4-yl-1-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]ethanone;dihydrochloride has a molecular weight of 413.35 g/mol, XLogP of -0.83, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-4-yl-1-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]ethanone;dihydrochloride is sourced from PubChem (CID 44783828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).