ethane;5-ethyl-3-hydroxyimidazolidine-2,4-dione

C7H14N2O3 — CID 166073631

IUPACethane;5-ethyl-3-hydroxyimidazolidine-2,4-dione
SMILESCC.CCC1NC(=O)N(O)C1=O
InChIInChI=1S/C5H8N2O3.C2H6/c1-2-3-4(8)7(10)5(9)6-3;1-2/h3,10H,2H2,1H3,(H,6,9);1-2H3
InChIKeyRBFZFMSFJMPHKJ-UHFFFAOYSA-N
MW174.20 g/mol
LogP0.73
Rot. Bonds1

About ethane;5-ethyl-3-hydroxyimidazolidine-2,4-dione

ethane;5-ethyl-3-hydroxyimidazolidine-2,4-dione (PubChem CID 166073631) has the molecular formula C7H14N2O3 and a molecular weight of 174.20 g/mol. Its IUPAC name is ethane;5-ethyl-3-hydroxyimidazolidine-2,4-dione.

Molecular Properties

Compound Nameethane;5-ethyl-3-hydroxyimidazolidine-2,4-dione
PubChem CID166073631
Molecular FormulaC7H14N2O3
Molecular Weight174.20 g/mol
Exact Mass174.10
IUPAC Nameethane;5-ethyl-3-hydroxyimidazolidine-2,4-dione
SMILESCC.CCC1NC(=O)N(O)C1=O
InChIInChI=1S/C5H8N2O3.C2H6/c1-2-3-4(8)7(10)5(9)6-3;1-2/h3,10H,2H2,1H3,(H,6,9);1-2H3
InChIKeyRBFZFMSFJMPHKJ-UHFFFAOYSA-N
XLogP0.73
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.20
LogP ≤ 50.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

5-ethyl-3-[(2S)-2-hydroxypropyl]imidazolidine-2,4-dione
CID 131041674
(5S)-3-(2-chloroprop-2-enyl)-5-ethylimidazolidine-2,4-dione
CID 130751870
1-cycloheptyl-3-ethylpiperazine-2,5-dione
CID 64960288
3-ethyl-1-methylpiperazine-2,5-dione
CID 64880969
3-ethyl-1-(2-fluoroethyl)-6,6-dimethylpiperazine-2,5-dione
CID 80696451
3-ethyl-1-methyl-1,4-diazepane-2,5-dione
CID 64881885
3,6,6-triethyl-1-(2-fluoroethyl)piperazine-2,5-dione
CID 80696620
6-cyclopropyl-3-ethyl-1-propylpiperazine-2,5-dione
CID 64901468
1-(1,1-dioxothian-4-yl)-3-ethylpiperazine-2,5-dione
CID 64960870
(5R)-5-ethyl-3-hexadecan-8-ylimidazolidine-2,4-dione
CID 167278979
1-cyclohexyl-3-ethyl-1,4-diazepane-2,5-dione
CID 64958811
6-cyclopropyl-3-ethyl-1-methylpiperazine-2,5-dione
CID 64903767

Frequently Asked Questions

What is the IUPAC name of ethane;5-ethyl-3-hydroxyimidazolidine-2,4-dione?
The IUPAC name of ethane;5-ethyl-3-hydroxyimidazolidine-2,4-dione (CID 166073631) is ethane;5-ethyl-3-hydroxyimidazolidine-2,4-dione.
What is the SMILES notation for ethane;5-ethyl-3-hydroxyimidazolidine-2,4-dione?
The canonical SMILES for ethane;5-ethyl-3-hydroxyimidazolidine-2,4-dione is CC.CCC1NC(=O)N(O)C1=O.
What is the InChIKey of ethane;5-ethyl-3-hydroxyimidazolidine-2,4-dione?
The InChIKey is RBFZFMSFJMPHKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N2O3.C2H6/c1-2-3-4(8)7(10)5(9)6-3;1-2/h3,10H,2H2,1H3,(H,6,9);1-2H3.
What are the key properties of ethane;5-ethyl-3-hydroxyimidazolidine-2,4-dione?
ethane;5-ethyl-3-hydroxyimidazolidine-2,4-dione has a molecular weight of 174.20 g/mol, XLogP of 0.73, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;5-ethyl-3-hydroxyimidazolidine-2,4-dione is sourced from PubChem (CID 166073631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).