3-(2-methyl-3-oxo-3-piperazin-1-ylpropyl)-1,3-oxazolidin-2-one

C11H19N3O3 — CID 82511477

IUPAC3-(2-methyl-3-oxo-3-piperazin-1-ylpropyl)-1,3-oxazolidin-2-one
SMILESCC(CN1CCOC1=O)C(=O)N1CCNCC1
InChIInChI=1S/C11H19N3O3/c1-9(8-14-6-7-17-11(14)16)10(15)13-4-2-12-3-5-13/h9,12H,2-8H2,1H3
InChIKeyQECJUHAIWJEWJS-UHFFFAOYSA-N
MW241.29 g/mol
LogP-0.49
Rot. Bonds3

About 3-(2-methyl-3-oxo-3-piperazin-1-ylpropyl)-1,3-oxazolidin-2-one

3-(2-methyl-3-oxo-3-piperazin-1-ylpropyl)-1,3-oxazolidin-2-one (PubChem CID 82511477) has the molecular formula C11H19N3O3 and a molecular weight of 241.29 g/mol. Its IUPAC name is 3-(2-methyl-3-oxo-3-piperazin-1-ylpropyl)-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name3-(2-methyl-3-oxo-3-piperazin-1-ylpropyl)-1,3-oxazolidin-2-one
PubChem CID82511477
Molecular FormulaC11H19N3O3
Molecular Weight241.29 g/mol
Exact Mass241.14
IUPAC Name3-(2-methyl-3-oxo-3-piperazin-1-ylpropyl)-1,3-oxazolidin-2-one
SMILESCC(CN1CCOC1=O)C(=O)N1CCNCC1
InChIInChI=1S/C11H19N3O3/c1-9(8-14-6-7-17-11(14)16)10(15)13-4-2-12-3-5-13/h9,12H,2-8H2,1H3
InChIKeyQECJUHAIWJEWJS-UHFFFAOYSA-N
XLogP-0.49
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 5-0.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-N-(2-morpholin-4-ylethyl)propanamide
CID 2053583
3-[3-(Piperazin-1-yl)propyl]-1,3-oxazolidin-2-one
CID 18430894
Methyl 3-[4-[(2-oxo-1,3-oxazolidin-5-yl)methyl]piperazin-1-yl]propanoate
CID 19071177
tert-butyl N-methyl-N-[3-(2-morpholin-4-ylethylamino)-3-oxopropyl]carbamate
CID 19753780
5-[(4-Methylpiperazin-1-yl)methyl]-1,3-oxazolidin-2-one
CID 20600757
N-(2-morpholin-4-ylethyl)pyrrolidine-3-carboxamide
CID 63007331
(3R)-N-(2-morpholin-4-ylethyl)pyrrolidine-3-carboxamide
CID 67294285
tert-butyl N-[3-(2-morpholin-4-ylethylamino)-3-oxopropyl]carbamate
CID 69175229
N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]propanamide
CID 110707157
2-methyl-N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]propanamide
CID 110707159
2-methyl-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]propanamide
CID 110710303
2-methyl-N-(3-morpholin-4-yl-3-oxopropyl)propanamide
CID 115578529

Frequently Asked Questions

What is the IUPAC name of 3-(2-methyl-3-oxo-3-piperazin-1-ylpropyl)-1,3-oxazolidin-2-one?
The IUPAC name of 3-(2-methyl-3-oxo-3-piperazin-1-ylpropyl)-1,3-oxazolidin-2-one (CID 82511477) is 3-(2-methyl-3-oxo-3-piperazin-1-ylpropyl)-1,3-oxazolidin-2-one.
What is the SMILES notation for 3-(2-methyl-3-oxo-3-piperazin-1-ylpropyl)-1,3-oxazolidin-2-one?
The canonical SMILES for 3-(2-methyl-3-oxo-3-piperazin-1-ylpropyl)-1,3-oxazolidin-2-one is CC(CN1CCOC1=O)C(=O)N1CCNCC1.
What is the InChIKey of 3-(2-methyl-3-oxo-3-piperazin-1-ylpropyl)-1,3-oxazolidin-2-one?
The InChIKey is QECJUHAIWJEWJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O3/c1-9(8-14-6-7-17-11(14)16)10(15)13-4-2-12-3-5-13/h9,12H,2-8H2,1H3.
What are the key properties of 3-(2-methyl-3-oxo-3-piperazin-1-ylpropyl)-1,3-oxazolidin-2-one?
3-(2-methyl-3-oxo-3-piperazin-1-ylpropyl)-1,3-oxazolidin-2-one has a molecular weight of 241.29 g/mol, XLogP of -0.49, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methyl-3-oxo-3-piperazin-1-ylpropyl)-1,3-oxazolidin-2-one is sourced from PubChem (CID 82511477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).