1-[2-(2-cyclohexyloxyethylamino)ethyl]imidazolidin-2-one

C13H25N3O2 — CID 63827692

IUPAC1-[2-(2-cyclohexyloxyethylamino)ethyl]imidazolidin-2-one
SMILESO=C1NCCN1CCNCCOC1CCCCC1
InChIInChI=1S/C13H25N3O2/c17-13-15-7-10-16(13)9-6-14-8-11-18-12-4-2-1-3-5-12/h12,14H,1-11H2,(H,15,17)
InChIKeyRNMQGIBMCMRBHZ-UHFFFAOYSA-N
MW255.36 g/mol
LogP0.95
Rot. Bonds7

About 1-[2-(2-cyclohexyloxyethylamino)ethyl]imidazolidin-2-one

1-[2-(2-cyclohexyloxyethylamino)ethyl]imidazolidin-2-one (PubChem CID 63827692) has the molecular formula C13H25N3O2 and a molecular weight of 255.36 g/mol. Its IUPAC name is 1-[2-(2-cyclohexyloxyethylamino)ethyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[2-(2-cyclohexyloxyethylamino)ethyl]imidazolidin-2-one
PubChem CID63827692
Molecular FormulaC13H25N3O2
Molecular Weight255.36 g/mol
Exact Mass255.19
IUPAC Name1-[2-(2-cyclohexyloxyethylamino)ethyl]imidazolidin-2-one
SMILESO=C1NCCN1CCNCCOC1CCCCC1
InChIInChI=1S/C13H25N3O2/c17-13-15-7-10-16(13)9-6-14-8-11-18-12-4-2-1-3-5-12/h12,14H,1-11H2,(H,15,17)
InChIKeyRNMQGIBMCMRBHZ-UHFFFAOYSA-N
XLogP0.95
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 50.95
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-cyclohexyloxyethylamino)ethyl]imidazolidin-2-one?
The IUPAC name of 1-[2-(2-cyclohexyloxyethylamino)ethyl]imidazolidin-2-one (CID 63827692) is 1-[2-(2-cyclohexyloxyethylamino)ethyl]imidazolidin-2-one.
What is the SMILES notation for 1-[2-(2-cyclohexyloxyethylamino)ethyl]imidazolidin-2-one?
The canonical SMILES for 1-[2-(2-cyclohexyloxyethylamino)ethyl]imidazolidin-2-one is O=C1NCCN1CCNCCOC1CCCCC1.
What is the InChIKey of 1-[2-(2-cyclohexyloxyethylamino)ethyl]imidazolidin-2-one?
The InChIKey is RNMQGIBMCMRBHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O2/c17-13-15-7-10-16(13)9-6-14-8-11-18-12-4-2-1-3-5-12/h12,14H,1-11H2,(H,15,17).
What are the key properties of 1-[2-(2-cyclohexyloxyethylamino)ethyl]imidazolidin-2-one?
1-[2-(2-cyclohexyloxyethylamino)ethyl]imidazolidin-2-one has a molecular weight of 255.36 g/mol, XLogP of 0.95, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-cyclohexyloxyethylamino)ethyl]imidazolidin-2-one is sourced from PubChem (CID 63827692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).