1-(3-morpholin-4-ylpropyl)piperazin-2-one

C11H21N3O2 — CID 57445037

IUPAC1-(3-morpholin-4-ylpropyl)piperazin-2-one
SMILESO=C1CNCCN1CCCN1CCOCC1
InChIInChI=1S/C11H21N3O2/c15-11-10-12-2-5-14(11)4-1-3-13-6-8-16-9-7-13/h12H,1-10H2
InChIKeyVUXKTTHZVBQVNF-UHFFFAOYSA-N
MW227.31 g/mol
LogP-0.86
Rot. Bonds4

About 1-(3-morpholin-4-ylpropyl)piperazin-2-one

1-(3-morpholin-4-ylpropyl)piperazin-2-one (PubChem CID 57445037) has the molecular formula C11H21N3O2 and a molecular weight of 227.31 g/mol. Its IUPAC name is 1-(3-morpholin-4-ylpropyl)piperazin-2-one.

Molecular Properties

Compound Name1-(3-morpholin-4-ylpropyl)piperazin-2-one
PubChem CID57445037
Molecular FormulaC11H21N3O2
Molecular Weight227.31 g/mol
Exact Mass227.16
IUPAC Name1-(3-morpholin-4-ylpropyl)piperazin-2-one
SMILESO=C1CNCCN1CCCN1CCOCC1
InChIInChI=1S/C11H21N3O2/c15-11-10-12-2-5-14(11)4-1-3-13-6-8-16-9-7-13/h12H,1-10H2
InChIKeyVUXKTTHZVBQVNF-UHFFFAOYSA-N
XLogP-0.86
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 5-0.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-hexylpiperazin-2-one
CID 62311409
1-(2-morpholin-4-yl-2-oxoethyl)piperazin-2-one
CID 62311600
3-(3-pyrrolidin-1-ylpropyl)imidazolidin-4-one
CID 83254942
1-[4-(dimethylamino)butyl]piperazin-2-one
CID 64565809
4-chloro-1-(3-morpholin-4-ylpropyl)pyrrolidin-2-one
CID 168688552
1-[3-(2-methoxyethoxy)propyl]piperazin-2-one
CID 103412181
ethane;4-(2-piperazin-1-ylethyl)morpholine
CID 143985030
4-ethenyl-1-(3-morpholin-4-ylpropyl)pyrrolidin-2-one
CID 168685224
4-[3-(7-methyl-1,4-diazepan-1-yl)propyl]morpholine
CID 82243837
2-(2-morpholin-4-ylethyl)-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-c]pyridin-3-one
CID 141302977
3,4-dimethyl-1-(3-morpholin-4-ylpropyl)pyrrole-2,5-dione
CID 25246712
1-(oxan-3-ylmethyl)piperazin-2-one
CID 64566013

Frequently Asked Questions

What is the IUPAC name of 1-(3-morpholin-4-ylpropyl)piperazin-2-one?
The IUPAC name of 1-(3-morpholin-4-ylpropyl)piperazin-2-one (CID 57445037) is 1-(3-morpholin-4-ylpropyl)piperazin-2-one.
What is the SMILES notation for 1-(3-morpholin-4-ylpropyl)piperazin-2-one?
The canonical SMILES for 1-(3-morpholin-4-ylpropyl)piperazin-2-one is O=C1CNCCN1CCCN1CCOCC1.
What is the InChIKey of 1-(3-morpholin-4-ylpropyl)piperazin-2-one?
The InChIKey is VUXKTTHZVBQVNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O2/c15-11-10-12-2-5-14(11)4-1-3-13-6-8-16-9-7-13/h12H,1-10H2.
What are the key properties of 1-(3-morpholin-4-ylpropyl)piperazin-2-one?
1-(3-morpholin-4-ylpropyl)piperazin-2-one has a molecular weight of 227.31 g/mol, XLogP of -0.86, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-morpholin-4-ylpropyl)piperazin-2-one is sourced from PubChem (CID 57445037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).