1-ethoxyimidazolidine-2-thione

C5H10N2OS — CID 150378710

IUPAC1-ethoxyimidazolidine-2-thione
SMILESCCON1CCNC1=S
InChIInChI=1S/C5H10N2OS/c1-2-8-7-4-3-6-5(7)9/h2-4H2,1H3,(H,6,9)
InChIKeyGZGJMCLJIRFCGA-UHFFFAOYSA-N
MW146.21 g/mol
LogP0.13
Rot. Bonds2

About 1-ethoxyimidazolidine-2-thione

1-ethoxyimidazolidine-2-thione (PubChem CID 150378710) has the molecular formula C5H10N2OS and a molecular weight of 146.21 g/mol. Its IUPAC name is 1-ethoxyimidazolidine-2-thione.

Molecular Properties

Compound Name1-ethoxyimidazolidine-2-thione
PubChem CID150378710
Molecular FormulaC5H10N2OS
Molecular Weight146.21 g/mol
Exact Mass146.05
IUPAC Name1-ethoxyimidazolidine-2-thione
SMILESCCON1CCNC1=S
InChIInChI=1S/C5H10N2OS/c1-2-8-7-4-3-6-5(7)9/h2-4H2,1H3,(H,6,9)
InChIKeyGZGJMCLJIRFCGA-UHFFFAOYSA-N
XLogP0.13
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.21
LogP ≤ 50.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 1-ethoxyimidazolidine-2-thione with MolForge

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

Launch Full Analysis

Related Compounds

1-methylimidazolidine-2-thione
CID 2733224
(2-sulfanylidene-1,3-diazinan-1-yl) acetate
CID 122591655
1-(1-triethoxysilylpropyl)imidazolidine-2-thione
CID 88615024
1-ethoxyazetidin-2-one
CID 130291069
1-propyl-1,3-diazepane-2-thione
CID 154491724
N-(2-ethoxyphenyl)-2-(2-sulfanylideneimidazolidin-1-yl)acetamide
CID 4751445
(4-ethoxy-3-methylpiperazin-2-ylidene)methanone
CID 176527174
1-methoxyimidazolidin-2-one
CID 18186072
1-(4-methoxyphenyl)imidazolidine-2-thione
CID 53443346
1-[2-(2-methylphenoxy)ethyl]imidazolidine-2-thione
CID 739239
(1-ethoxy-2,5-dihydropyridin-6-ylidene)methanone
CID 174439652
ethyl N-[(5-oxo-1,4-diazepan-1-yl)sulfonyl]carbamate
CID 114464489

Frequently Asked Questions

What is the IUPAC name of 1-ethoxyimidazolidine-2-thione?
The IUPAC name of 1-ethoxyimidazolidine-2-thione (CID 150378710) is 1-ethoxyimidazolidine-2-thione.
What is the SMILES notation for 1-ethoxyimidazolidine-2-thione?
The canonical SMILES for 1-ethoxyimidazolidine-2-thione is CCON1CCNC1=S.
What is the InChIKey of 1-ethoxyimidazolidine-2-thione?
The InChIKey is GZGJMCLJIRFCGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2OS/c1-2-8-7-4-3-6-5(7)9/h2-4H2,1H3,(H,6,9).
What are the key properties of 1-ethoxyimidazolidine-2-thione?
1-ethoxyimidazolidine-2-thione has a molecular weight of 146.21 g/mol, XLogP of 0.13, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethoxyimidazolidine-2-thione is sourced from PubChem (CID 150378710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).