1-(morpholin-4-ylmethyl)piperazin-2-one

C9H17N3O2 — CID 67116143

IUPAC1-(morpholin-4-ylmethyl)piperazin-2-one
SMILESO=C1CNCCN1CN1CCOCC1
InChIInChI=1S/C9H17N3O2/c13-9-7-10-1-2-12(9)8-11-3-5-14-6-4-11/h10H,1-8H2
InChIKeyWOOABBWUISUPCU-UHFFFAOYSA-N
MW199.25 g/mol
LogP-1.29
Rot. Bonds2

About 1-(morpholin-4-ylmethyl)piperazin-2-one

1-(morpholin-4-ylmethyl)piperazin-2-one (PubChem CID 67116143) has the molecular formula C9H17N3O2 and a molecular weight of 199.25 g/mol. Its IUPAC name is 1-(morpholin-4-ylmethyl)piperazin-2-one.

Molecular Properties

Compound Name1-(morpholin-4-ylmethyl)piperazin-2-one
PubChem CID67116143
Molecular FormulaC9H17N3O2
Molecular Weight199.25 g/mol
Exact Mass199.13
IUPAC Name1-(morpholin-4-ylmethyl)piperazin-2-one
SMILESO=C1CNCCN1CN1CCOCC1
InChIInChI=1S/C9H17N3O2/c13-9-7-10-1-2-12(9)8-11-3-5-14-6-4-11/h10H,1-8H2
InChIKeyWOOABBWUISUPCU-UHFFFAOYSA-N
XLogP-1.29
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.25
LogP ≤ 5-1.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(1-Piperazinylcarbonyl)morpholine
CID 700139
1-(Morpholinocarbonylmethyl)piperazine
CID 100622
N,N'-1,2-ethanediylbis[2-(4-morpholinyl)acetamide]
CID 2922084
4-[Oxo(piperazin-1-yl)acetyl]morpholine
CID 7131953
N-[2-(morpholin-4-yl)ethyl]morpholine-4-carboxamide
CID 654403
2-(Morpholin-4-yl)-1-(piperazin-1-yl)ethan-1-one
CID 16227632
4-(Piperazine-1-carbonyl)morpholine hydrochloride
CID 16382667
3-(Morpholin-4-ylmethyl)imidazolidine-2,4-dione
CID 336388
1-(Morpholin-4-yl)-2-(piperazin-1-yl)ethan-1-one dihydrochloride
CID 16413967
1-(2-Morpholin-4-ylethyl)piperazine-2,6-dione
CID 66063624
N,N'-bis[2-(morpholin-4-yl)ethyl]ethanediamide
CID 3136337
2-morpholin-4-ium-4-yl-N-(2,2,2-trifluoroethylcarbamoyl)acetamide
CID 8434642

Frequently Asked Questions

What is the IUPAC name of 1-(morpholin-4-ylmethyl)piperazin-2-one?
The IUPAC name of 1-(morpholin-4-ylmethyl)piperazin-2-one (CID 67116143) is 1-(morpholin-4-ylmethyl)piperazin-2-one.
What is the SMILES notation for 1-(morpholin-4-ylmethyl)piperazin-2-one?
The canonical SMILES for 1-(morpholin-4-ylmethyl)piperazin-2-one is O=C1CNCCN1CN1CCOCC1.
What is the InChIKey of 1-(morpholin-4-ylmethyl)piperazin-2-one?
The InChIKey is WOOABBWUISUPCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3O2/c13-9-7-10-1-2-12(9)8-11-3-5-14-6-4-11/h10H,1-8H2.
What are the key properties of 1-(morpholin-4-ylmethyl)piperazin-2-one?
1-(morpholin-4-ylmethyl)piperazin-2-one has a molecular weight of 199.25 g/mol, XLogP of -1.29, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(morpholin-4-ylmethyl)piperazin-2-one is sourced from PubChem (CID 67116143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).