5-ethyl-3-(2-hydroxyethyl)-5-[2-[methyl(propyl)amino]ethyl]imidazolidine-2,4-dione

C13H25N3O3 — CID 135257359

IUPAC5-ethyl-3-(2-hydroxyethyl)-5-[2-[methyl(propyl)amino]ethyl]imidazolidine-2,4-dione
SMILESCCCN(C)CCC1(CC)NC(=O)N(CCO)C1=O
InChIInChI=1S/C13H25N3O3/c1-4-7-15(3)8-6-13(5-2)11(18)16(9-10-17)12(19)14-13/h17H,4-10H2,1-3H3,(H,14,19)
InChIKeyRAHBIPRXSGKIKF-UHFFFAOYSA-N
MW271.36 g/mol
LogP0.41
Rot. Bonds8

About 5-ethyl-3-(2-hydroxyethyl)-5-[2-[methyl(propyl)amino]ethyl]imidazolidine-2,4-dione

5-ethyl-3-(2-hydroxyethyl)-5-[2-[methyl(propyl)amino]ethyl]imidazolidine-2,4-dione (PubChem CID 135257359) has the molecular formula C13H25N3O3 and a molecular weight of 271.36 g/mol. Its IUPAC name is 5-ethyl-3-(2-hydroxyethyl)-5-[2-[methyl(propyl)amino]ethyl]imidazolidine-2,4-dione.

Molecular Properties

Compound Name5-ethyl-3-(2-hydroxyethyl)-5-[2-[methyl(propyl)amino]ethyl]imidazolidine-2,4-dione
PubChem CID135257359
Molecular FormulaC13H25N3O3
Molecular Weight271.36 g/mol
Exact Mass271.19
IUPAC Name5-ethyl-3-(2-hydroxyethyl)-5-[2-[methyl(propyl)amino]ethyl]imidazolidine-2,4-dione
SMILESCCCN(C)CCC1(CC)NC(=O)N(CCO)C1=O
InChIInChI=1S/C13H25N3O3/c1-4-7-15(3)8-6-13(5-2)11(18)16(9-10-17)12(19)14-13/h17H,4-10H2,1-3H3,(H,14,19)
InChIKeyRAHBIPRXSGKIKF-UHFFFAOYSA-N
XLogP0.41
TPSA72.88 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 50.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-3-(2-hydroxyethyl)-5-[2-[methyl(propyl)amino]ethyl]imidazolidine-2,4-dione?
The IUPAC name of 5-ethyl-3-(2-hydroxyethyl)-5-[2-[methyl(propyl)amino]ethyl]imidazolidine-2,4-dione (CID 135257359) is 5-ethyl-3-(2-hydroxyethyl)-5-[2-[methyl(propyl)amino]ethyl]imidazolidine-2,4-dione.
What is the SMILES notation for 5-ethyl-3-(2-hydroxyethyl)-5-[2-[methyl(propyl)amino]ethyl]imidazolidine-2,4-dione?
The canonical SMILES for 5-ethyl-3-(2-hydroxyethyl)-5-[2-[methyl(propyl)amino]ethyl]imidazolidine-2,4-dione is CCCN(C)CCC1(CC)NC(=O)N(CCO)C1=O.
What is the InChIKey of 5-ethyl-3-(2-hydroxyethyl)-5-[2-[methyl(propyl)amino]ethyl]imidazolidine-2,4-dione?
The InChIKey is RAHBIPRXSGKIKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O3/c1-4-7-15(3)8-6-13(5-2)11(18)16(9-10-17)12(19)14-13/h17H,4-10H2,1-3H3,(H,14,19).
What are the key properties of 5-ethyl-3-(2-hydroxyethyl)-5-[2-[methyl(propyl)amino]ethyl]imidazolidine-2,4-dione?
5-ethyl-3-(2-hydroxyethyl)-5-[2-[methyl(propyl)amino]ethyl]imidazolidine-2,4-dione has a molecular weight of 271.36 g/mol, XLogP of 0.41, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-3-(2-hydroxyethyl)-5-[2-[methyl(propyl)amino]ethyl]imidazolidine-2,4-dione is sourced from PubChem (CID 135257359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).