1,3-dimethyl-4-(2-oxo-2-piperazin-1-ylethyl)imidazol-2-one

C11H18N4O2 — CID 82511043

IUPAC1,3-dimethyl-4-(2-oxo-2-piperazin-1-ylethyl)imidazol-2-one
SMILESCn1cc(CC(=O)N2CCNCC2)n(C)c1=O
InChIInChI=1S/C11H18N4O2/c1-13-8-9(14(2)11(13)17)7-10(16)15-5-3-12-4-6-15/h8,12H,3-7H2,1-2H3
InChIKeyAMUPKLZSUQVNNF-UHFFFAOYSA-N
MW238.29 g/mol
LogP-1.30
Rot. Bonds2

About 1,3-dimethyl-4-(2-oxo-2-piperazin-1-ylethyl)imidazol-2-one

1,3-dimethyl-4-(2-oxo-2-piperazin-1-ylethyl)imidazol-2-one (PubChem CID 82511043) has the molecular formula C11H18N4O2 and a molecular weight of 238.29 g/mol. Its IUPAC name is 1,3-dimethyl-4-(2-oxo-2-piperazin-1-ylethyl)imidazol-2-one.

Molecular Properties

Compound Name1,3-dimethyl-4-(2-oxo-2-piperazin-1-ylethyl)imidazol-2-one
PubChem CID82511043
Molecular FormulaC11H18N4O2
Molecular Weight238.29 g/mol
Exact Mass238.14
IUPAC Name1,3-dimethyl-4-(2-oxo-2-piperazin-1-ylethyl)imidazol-2-one
SMILESCn1cc(CC(=O)N2CCNCC2)n(C)c1=O
InChIInChI=1S/C11H18N4O2/c1-13-8-9(14(2)11(13)17)7-10(16)15-5-3-12-4-6-15/h8,12H,3-7H2,1-2H3
InChIKeyAMUPKLZSUQVNNF-UHFFFAOYSA-N
XLogP-1.30
TPSA59.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 5-1.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-[(Dimethylamino)methylene] amino-1,3-dimethyl uracil
CID 129732221
4-Hydroxy-5-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-1,3-dihydroimidazol-2-one
CID 90842977
3-[2-[3-Aminopropyl(methyl)amino]-5-methyl-3-oxo-1,2-dihydropyrazin-4-yl]propanamide
CID 118614670
N-[2-(3-ethyl-1,2-dihydroimidazol-5-yl)ethyl]acetamide
CID 142959961
N-[2-(3-methyl-1-propyl-2H-imidazol-4-yl)ethyl]acetamide
CID 142959966
6-Methylidene-1,3-diazinane-2,4-dione;piperazine
CID 159527951
1-[[[(E)-1-(methylamino)but-1-en-2-yl]amino]methyl]piperazin-2-one
CID 169683456
1-(1,2-dimethyl-3H-pyrazol-4-yl)-1,3-diazinane-2,4-dione;ethane
CID 171565064
ethane;1-[(E)-1-(ethenylamino)but-1-en-2-yl]-1,3-diazinane-2,4-dione
CID 171565175
N,N-diethyl-2-(2-oxo-1,3-dihydroimidazol-4-yl)acetamide
CID 23629707
2-(2-oxo-1,3-dihydroimidazol-4-yl)-N-propylacetamide
CID 23629708
2-(2-oxo-1,3-dihydroimidazol-4-yl)-N,N-dipropylacetamide
CID 23629709

Frequently Asked Questions

What is the IUPAC name of 1,3-dimethyl-4-(2-oxo-2-piperazin-1-ylethyl)imidazol-2-one?
The IUPAC name of 1,3-dimethyl-4-(2-oxo-2-piperazin-1-ylethyl)imidazol-2-one (CID 82511043) is 1,3-dimethyl-4-(2-oxo-2-piperazin-1-ylethyl)imidazol-2-one.
What is the SMILES notation for 1,3-dimethyl-4-(2-oxo-2-piperazin-1-ylethyl)imidazol-2-one?
The canonical SMILES for 1,3-dimethyl-4-(2-oxo-2-piperazin-1-ylethyl)imidazol-2-one is Cn1cc(CC(=O)N2CCNCC2)n(C)c1=O.
What is the InChIKey of 1,3-dimethyl-4-(2-oxo-2-piperazin-1-ylethyl)imidazol-2-one?
The InChIKey is AMUPKLZSUQVNNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O2/c1-13-8-9(14(2)11(13)17)7-10(16)15-5-3-12-4-6-15/h8,12H,3-7H2,1-2H3.
What are the key properties of 1,3-dimethyl-4-(2-oxo-2-piperazin-1-ylethyl)imidazol-2-one?
1,3-dimethyl-4-(2-oxo-2-piperazin-1-ylethyl)imidazol-2-one has a molecular weight of 238.29 g/mol, XLogP of -1.30, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethyl-4-(2-oxo-2-piperazin-1-ylethyl)imidazol-2-one is sourced from PubChem (CID 82511043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).