1-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl]pyrrole-2,5-dione

C10H15NO5 — CID 19880613

IUPAC1-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl]pyrrole-2,5-dione
SMILESO=C1C=CC(=O)N1CCOCCOCCO
InChIInChI=1S/C10H15NO5/c12-4-6-16-8-7-15-5-3-11-9(13)1-2-10(11)14/h1-2,12H,3-8H2
InChIKeyDRANPRSEAZUMPF-UHFFFAOYSA-N
MW229.23 g/mol
LogP-1.06
Rot. Bonds8

About 1-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl]pyrrole-2,5-dione

1-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl]pyrrole-2,5-dione (PubChem CID 19880613) has the molecular formula C10H15NO5 and a molecular weight of 229.23 g/mol. Its IUPAC name is 1-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl]pyrrole-2,5-dione.

Molecular Properties

Compound Name1-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl]pyrrole-2,5-dione
PubChem CID19880613
Molecular FormulaC10H15NO5
Molecular Weight229.23 g/mol
Exact Mass229.10
IUPAC Name1-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl]pyrrole-2,5-dione
SMILESO=C1C=CC(=O)N1CCOCCOCCO
InChIInChI=1S/C10H15NO5/c12-4-6-16-8-7-15-5-3-11-9(13)1-2-10(11)14/h1-2,12H,3-8H2
InChIKeyDRANPRSEAZUMPF-UHFFFAOYSA-N
XLogP-1.06
TPSA76.07 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.23
LogP ≤ 5-1.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl]pyrrole-2,5-dione?
The IUPAC name of 1-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl]pyrrole-2,5-dione (CID 19880613) is 1-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl]pyrrole-2,5-dione.
What is the SMILES notation for 1-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl]pyrrole-2,5-dione?
The canonical SMILES for 1-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl]pyrrole-2,5-dione is O=C1C=CC(=O)N1CCOCCOCCO.
What is the InChIKey of 1-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl]pyrrole-2,5-dione?
The InChIKey is DRANPRSEAZUMPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO5/c12-4-6-16-8-7-15-5-3-11-9(13)1-2-10(11)14/h1-2,12H,3-8H2.
What are the key properties of 1-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl]pyrrole-2,5-dione?
1-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl]pyrrole-2,5-dione has a molecular weight of 229.23 g/mol, XLogP of -1.06, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl]pyrrole-2,5-dione is sourced from PubChem (CID 19880613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).