1-[2-(dimethylamino)ethyl]-3-methylimidazolidine-2,4,5-trione;hydrochloride

C8H14ClN3O3 — CID 6366881

IUPAC1-[2-(dimethylamino)ethyl]-3-methylimidazolidine-2,4,5-trione;hydrochloride
SMILESCN(C)CCN1C(=O)C(=O)N(C)C1=O.Cl
InChIInChI=1S/C8H13N3O3.ClH/c1-9(2)4-5-11-7(13)6(12)10(3)8(11)14;/h4-5H2,1-3H3;1H
InChIKeyRTMJFPXCFIWCOE-UHFFFAOYSA-N
MW235.67 g/mol
LogP-0.61
Rot. Bonds3

About 1-[2-(dimethylamino)ethyl]-3-methylimidazolidine-2,4,5-trione;hydrochloride

1-[2-(dimethylamino)ethyl]-3-methylimidazolidine-2,4,5-trione;hydrochloride (PubChem CID 6366881) has the molecular formula C8H14ClN3O3 and a molecular weight of 235.67 g/mol. Its IUPAC name is 1-[2-(dimethylamino)ethyl]-3-methylimidazolidine-2,4,5-trione;hydrochloride.

Molecular Properties

Compound Name1-[2-(dimethylamino)ethyl]-3-methylimidazolidine-2,4,5-trione;hydrochloride
PubChem CID6366881
Molecular FormulaC8H14ClN3O3
Molecular Weight235.67 g/mol
Exact Mass235.07
IUPAC Name1-[2-(dimethylamino)ethyl]-3-methylimidazolidine-2,4,5-trione;hydrochloride
SMILESCN(C)CCN1C(=O)C(=O)N(C)C1=O.Cl
InChIInChI=1S/C8H13N3O3.ClH/c1-9(2)4-5-11-7(13)6(12)10(3)8(11)14;/h4-5H2,1-3H3;1H
InChIKeyRTMJFPXCFIWCOE-UHFFFAOYSA-N
XLogP-0.61
TPSA60.93 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.67
LogP ≤ 5-0.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(dimethylamino)ethyl]-3-methylimidazolidine-2,4,5-trione;hydrochloride?
The IUPAC name of 1-[2-(dimethylamino)ethyl]-3-methylimidazolidine-2,4,5-trione;hydrochloride (CID 6366881) is 1-[2-(dimethylamino)ethyl]-3-methylimidazolidine-2,4,5-trione;hydrochloride.
What is the SMILES notation for 1-[2-(dimethylamino)ethyl]-3-methylimidazolidine-2,4,5-trione;hydrochloride?
The canonical SMILES for 1-[2-(dimethylamino)ethyl]-3-methylimidazolidine-2,4,5-trione;hydrochloride is CN(C)CCN1C(=O)C(=O)N(C)C1=O.Cl.
What is the InChIKey of 1-[2-(dimethylamino)ethyl]-3-methylimidazolidine-2,4,5-trione;hydrochloride?
The InChIKey is RTMJFPXCFIWCOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3O3.ClH/c1-9(2)4-5-11-7(13)6(12)10(3)8(11)14;/h4-5H2,1-3H3;1H.
What are the key properties of 1-[2-(dimethylamino)ethyl]-3-methylimidazolidine-2,4,5-trione;hydrochloride?
1-[2-(dimethylamino)ethyl]-3-methylimidazolidine-2,4,5-trione;hydrochloride has a molecular weight of 235.67 g/mol, XLogP of -0.61, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(dimethylamino)ethyl]-3-methylimidazolidine-2,4,5-trione;hydrochloride is sourced from PubChem (CID 6366881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).