5-cyclopropyl-5-methyl-3-[2-(2-methylpiperazin-1-yl)-2-oxoethyl]imidazolidine-2,4-dione;hydrochloride

C14H23ClN4O3 — CID 119470389

IUPAC5-cyclopropyl-5-methyl-3-[2-(2-methylpiperazin-1-yl)-2-oxoethyl]imidazolidine-2,4-dione;hydrochloride
SMILESCC1CNCCN1C(=O)CN1C(=O)NC(C)(C2CC2)C1=O.Cl
InChIInChI=1S/C14H22N4O3.ClH/c1-9-7-15-5-6-17(9)11(19)8-18-12(20)14(2,10-3-4-10)16-13(18)21;/h9-10,15H,3-8H2,1-2H3,(H,16,21);1H
InChIKeyRDUIJNLBJVOKRV-UHFFFAOYSA-N
MW330.82 g/mol
LogP-0.05
Rot. Bonds3

About 5-cyclopropyl-5-methyl-3-[2-(2-methylpiperazin-1-yl)-2-oxoethyl]imidazolidine-2,4-dione;hydrochloride

5-cyclopropyl-5-methyl-3-[2-(2-methylpiperazin-1-yl)-2-oxoethyl]imidazolidine-2,4-dione;hydrochloride (PubChem CID 119470389) has the molecular formula C14H23ClN4O3 and a molecular weight of 330.82 g/mol. Its IUPAC name is 5-cyclopropyl-5-methyl-3-[2-(2-methylpiperazin-1-yl)-2-oxoethyl]imidazolidine-2,4-dione;hydrochloride.

Molecular Properties

Compound Name5-cyclopropyl-5-methyl-3-[2-(2-methylpiperazin-1-yl)-2-oxoethyl]imidazolidine-2,4-dione;hydrochloride
PubChem CID119470389
Molecular FormulaC14H23ClN4O3
Molecular Weight330.82 g/mol
Exact Mass330.15
IUPAC Name5-cyclopropyl-5-methyl-3-[2-(2-methylpiperazin-1-yl)-2-oxoethyl]imidazolidine-2,4-dione;hydrochloride
SMILESCC1CNCCN1C(=O)CN1C(=O)NC(C)(C2CC2)C1=O.Cl
InChIInChI=1S/C14H22N4O3.ClH/c1-9-7-15-5-6-17(9)11(19)8-18-12(20)14(2,10-3-4-10)16-13(18)21;/h9-10,15H,3-8H2,1-2H3,(H,16,21);1H
InChIKeyRDUIJNLBJVOKRV-UHFFFAOYSA-N
XLogP-0.05
TPSA81.75 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.82
LogP ≤ 5-0.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 5-cyclopropyl-5-methyl-3-[2-(2-methylpiperazin-1-yl)-2-oxoethyl]imidazolidine-2,4-dione;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-5-methyl-3-[2-(2-methylpiperazin-1-yl)-2-oxoethyl]imidazolidine-2,4-dione;hydrochloride?
The IUPAC name of 5-cyclopropyl-5-methyl-3-[2-(2-methylpiperazin-1-yl)-2-oxoethyl]imidazolidine-2,4-dione;hydrochloride (CID 119470389) is 5-cyclopropyl-5-methyl-3-[2-(2-methylpiperazin-1-yl)-2-oxoethyl]imidazolidine-2,4-dione;hydrochloride.
What is the SMILES notation for 5-cyclopropyl-5-methyl-3-[2-(2-methylpiperazin-1-yl)-2-oxoethyl]imidazolidine-2,4-dione;hydrochloride?
The canonical SMILES for 5-cyclopropyl-5-methyl-3-[2-(2-methylpiperazin-1-yl)-2-oxoethyl]imidazolidine-2,4-dione;hydrochloride is CC1CNCCN1C(=O)CN1C(=O)NC(C)(C2CC2)C1=O.Cl.
What is the InChIKey of 5-cyclopropyl-5-methyl-3-[2-(2-methylpiperazin-1-yl)-2-oxoethyl]imidazolidine-2,4-dione;hydrochloride?
The InChIKey is RDUIJNLBJVOKRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O3.ClH/c1-9-7-15-5-6-17(9)11(19)8-18-12(20)14(2,10-3-4-10)16-13(18)21;/h9-10,15H,3-8H2,1-2H3,(H,16,21);1H.
What are the key properties of 5-cyclopropyl-5-methyl-3-[2-(2-methylpiperazin-1-yl)-2-oxoethyl]imidazolidine-2,4-dione;hydrochloride?
5-cyclopropyl-5-methyl-3-[2-(2-methylpiperazin-1-yl)-2-oxoethyl]imidazolidine-2,4-dione;hydrochloride has a molecular weight of 330.82 g/mol, XLogP of -0.05, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-5-methyl-3-[2-(2-methylpiperazin-1-yl)-2-oxoethyl]imidazolidine-2,4-dione;hydrochloride is sourced from PubChem (CID 119470389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).