1-cyclopropyl-3-[2-(2-hydroxyethoxy)ethyl]imidazol-2-one

C10H16N2O3 — CID 80582173

IUPAC1-cyclopropyl-3-[2-(2-hydroxyethoxy)ethyl]imidazol-2-one
SMILESO=c1n(CCOCCO)ccn1C1CC1
InChIInChI=1S/C10H16N2O3/c13-6-8-15-7-5-11-3-4-12(10(11)14)9-1-2-9/h3-4,9,13H,1-2,5-8H2
InChIKeyNLBDWYJBQAKPJF-UHFFFAOYSA-N
MW212.25 g/mol
LogP-0.01
Rot. Bonds6

About 1-cyclopropyl-3-[2-(2-hydroxyethoxy)ethyl]imidazol-2-one

1-cyclopropyl-3-[2-(2-hydroxyethoxy)ethyl]imidazol-2-one (PubChem CID 80582173) has the molecular formula C10H16N2O3 and a molecular weight of 212.25 g/mol. Its IUPAC name is 1-cyclopropyl-3-[2-(2-hydroxyethoxy)ethyl]imidazol-2-one.

Molecular Properties

Compound Name1-cyclopropyl-3-[2-(2-hydroxyethoxy)ethyl]imidazol-2-one
PubChem CID80582173
Molecular FormulaC10H16N2O3
Molecular Weight212.25 g/mol
Exact Mass212.12
IUPAC Name1-cyclopropyl-3-[2-(2-hydroxyethoxy)ethyl]imidazol-2-one
SMILESO=c1n(CCOCCO)ccn1C1CC1
InChIInChI=1S/C10H16N2O3/c13-6-8-15-7-5-11-3-4-12(10(11)14)9-1-2-9/h3-4,9,13H,1-2,5-8H2
InChIKeyNLBDWYJBQAKPJF-UHFFFAOYSA-N
XLogP-0.01
TPSA56.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.25
LogP ≤ 5-0.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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-cyclopropyl-3-[2-(2-hydroxyethoxy)ethyl]imidazol-2-one?
The IUPAC name of 1-cyclopropyl-3-[2-(2-hydroxyethoxy)ethyl]imidazol-2-one (CID 80582173) is 1-cyclopropyl-3-[2-(2-hydroxyethoxy)ethyl]imidazol-2-one.
What is the SMILES notation for 1-cyclopropyl-3-[2-(2-hydroxyethoxy)ethyl]imidazol-2-one?
The canonical SMILES for 1-cyclopropyl-3-[2-(2-hydroxyethoxy)ethyl]imidazol-2-one is O=c1n(CCOCCO)ccn1C1CC1.
What is the InChIKey of 1-cyclopropyl-3-[2-(2-hydroxyethoxy)ethyl]imidazol-2-one?
The InChIKey is NLBDWYJBQAKPJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O3/c13-6-8-15-7-5-11-3-4-12(10(11)14)9-1-2-9/h3-4,9,13H,1-2,5-8H2.
What are the key properties of 1-cyclopropyl-3-[2-(2-hydroxyethoxy)ethyl]imidazol-2-one?
1-cyclopropyl-3-[2-(2-hydroxyethoxy)ethyl]imidazol-2-one has a molecular weight of 212.25 g/mol, XLogP of -0.01, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-3-[2-(2-hydroxyethoxy)ethyl]imidazol-2-one is sourced from PubChem (CID 80582173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).