1-[2-[2-(methylamino)ethoxy]ethyl]imidazolidin-2-one

C8H17N3O2 — CID 22381335

IUPAC1-[2-[2-(methylamino)ethoxy]ethyl]imidazolidin-2-one
SMILESCNCCOCCN1CCNC1=O
InChIInChI=1S/C8H17N3O2/c1-9-3-6-13-7-5-11-4-2-10-8(11)12/h9H,2-7H2,1H3,(H,10,12)
InChIKeyHYBUEPREQINRFM-UHFFFAOYSA-N
MW187.24 g/mol
LogP-0.75
Rot. Bonds6

About 1-[2-[2-(methylamino)ethoxy]ethyl]imidazolidin-2-one

1-[2-[2-(methylamino)ethoxy]ethyl]imidazolidin-2-one (PubChem CID 22381335) has the molecular formula C8H17N3O2 and a molecular weight of 187.24 g/mol. Its IUPAC name is 1-[2-[2-(methylamino)ethoxy]ethyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[2-[2-(methylamino)ethoxy]ethyl]imidazolidin-2-one
PubChem CID22381335
Molecular FormulaC8H17N3O2
Molecular Weight187.24 g/mol
Exact Mass187.13
IUPAC Name1-[2-[2-(methylamino)ethoxy]ethyl]imidazolidin-2-one
SMILESCNCCOCCN1CCNC1=O
InChIInChI=1S/C8H17N3O2/c1-9-3-6-13-7-5-11-4-2-10-8(11)12/h9H,2-7H2,1H3,(H,10,12)
InChIKeyHYBUEPREQINRFM-UHFFFAOYSA-N
XLogP-0.75
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.24
LogP ≤ 5-0.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-[2-[2-(methylamino)ethoxy]ethyl]imidazolidin-2-one?
The IUPAC name of 1-[2-[2-(methylamino)ethoxy]ethyl]imidazolidin-2-one (CID 22381335) is 1-[2-[2-(methylamino)ethoxy]ethyl]imidazolidin-2-one.
What is the SMILES notation for 1-[2-[2-(methylamino)ethoxy]ethyl]imidazolidin-2-one?
The canonical SMILES for 1-[2-[2-(methylamino)ethoxy]ethyl]imidazolidin-2-one is CNCCOCCN1CCNC1=O.
What is the InChIKey of 1-[2-[2-(methylamino)ethoxy]ethyl]imidazolidin-2-one?
The InChIKey is HYBUEPREQINRFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N3O2/c1-9-3-6-13-7-5-11-4-2-10-8(11)12/h9H,2-7H2,1H3,(H,10,12).
What are the key properties of 1-[2-[2-(methylamino)ethoxy]ethyl]imidazolidin-2-one?
1-[2-[2-(methylamino)ethoxy]ethyl]imidazolidin-2-one has a molecular weight of 187.24 g/mol, XLogP of -0.75, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[2-(methylamino)ethoxy]ethyl]imidazolidin-2-one is sourced from PubChem (CID 22381335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).