4,5-diiodo-2-methylimidazolidine

C4H8I2N2 — CID 44558832

IUPAC4,5-diiodo-2-methylimidazolidine
SMILESCC1NC(I)C(I)N1
InChIInChI=1S/C4H8I2N2/c1-2-7-3(5)4(6)8-2/h2-4,7-8H,1H3
InChIKeyBEMXDOODJSZHJW-UHFFFAOYSA-N
MW337.93 g/mol
LogP1.05
Rot. Bonds

About 4,5-diiodo-2-methylimidazolidine

4,5-diiodo-2-methylimidazolidine (PubChem CID 44558832) has the molecular formula C4H8I2N2 and a molecular weight of 337.93 g/mol. Its IUPAC name is 4,5-diiodo-2-methylimidazolidine.

Molecular Properties

Compound Name4,5-diiodo-2-methylimidazolidine
PubChem CID44558832
Molecular FormulaC4H8I2N2
Molecular Weight337.93 g/mol
Exact Mass337.88
IUPAC Name4,5-diiodo-2-methylimidazolidine
SMILESCC1NC(I)C(I)N1
InChIInChI=1S/C4H8I2N2/c1-2-7-3(5)4(6)8-2/h2-4,7-8H,1H3
InChIKeyBEMXDOODJSZHJW-UHFFFAOYSA-N
XLogP1.05
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.93
LogP ≤ 51.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'N-C-halo', 'substructure': 'N/A'}

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Related Compounds

2,4,6-trimethyl-1,3,5-triazinane;hydrate
CID 156588362
3,5-dimethyl-1,2,4-triazolidine
CID 5231545
4-iodo-5-methylimidazolidin-2-one
CID 147926542
2-methylimidazolidine-4,5-dicarbonitrile
CID 91522645
2,5-dimethyl-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-d]imidazole
CID 162695078
3-methyl-1,2,4,5-tetrazinane
CID 140509689
4-methanidyl-2,6-dimethyl-1,3-diazinane
CID 171585831
4-iodo-5-methyl-1,3-diazinane
CID 155155495
2,6-dimethylpiperazin-4-ium
CID 75740716
CID 171048545
CID 171048545
4-iodo-5-methyl-2-oxoimidazolidine-1-sulfonic acid
CID 155214696
CID 102399590
CID 102399590

Frequently Asked Questions

What is the IUPAC name of 4,5-diiodo-2-methylimidazolidine?
The IUPAC name of 4,5-diiodo-2-methylimidazolidine (CID 44558832) is 4,5-diiodo-2-methylimidazolidine.
What is the SMILES notation for 4,5-diiodo-2-methylimidazolidine?
The canonical SMILES for 4,5-diiodo-2-methylimidazolidine is CC1NC(I)C(I)N1.
What is the InChIKey of 4,5-diiodo-2-methylimidazolidine?
The InChIKey is BEMXDOODJSZHJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8I2N2/c1-2-7-3(5)4(6)8-2/h2-4,7-8H,1H3.
What are the key properties of 4,5-diiodo-2-methylimidazolidine?
4,5-diiodo-2-methylimidazolidine has a molecular weight of 337.93 g/mol, XLogP of 1.05, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-diiodo-2-methylimidazolidine is sourced from PubChem (CID 44558832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).