2,5-dimethyl-1H-imidazole;hydroiodide

C5H9IN2 — CID 174505466

IUPAC2,5-dimethyl-1H-imidazole;hydroiodide
SMILESCc1cnc(C)[nH]1.I
InChIInChI=1S/C5H8N2.HI/c1-4-3-6-5(2)7-4;/h3H,1-2H3,(H,6,7);1H
InChIKeyDJIUTIIZORPCNV-UHFFFAOYSA-N
MW224.04 g/mol
LogP1.64
Rot. Bonds

About 2,5-dimethyl-1H-imidazole;hydroiodide

2,5-dimethyl-1H-imidazole;hydroiodide (PubChem CID 174505466) has the molecular formula C5H9IN2 and a molecular weight of 224.04 g/mol. Its IUPAC name is 2,5-dimethyl-1H-imidazole;hydroiodide.

Molecular Properties

Compound Name2,5-dimethyl-1H-imidazole;hydroiodide
PubChem CID174505466
Molecular FormulaC5H9IN2
Molecular Weight224.04 g/mol
Exact Mass223.98
IUPAC Name2,5-dimethyl-1H-imidazole;hydroiodide
SMILESCc1cnc(C)[nH]1.I
InChIInChI=1S/C5H8N2.HI/c1-4-3-6-5(2)7-4;/h3H,1-2H3,(H,6,7);1H
InChIKeyDJIUTIIZORPCNV-UHFFFAOYSA-N
XLogP1.64
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.04
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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CID 173289689
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2,5-dimethyl-1H-imidazole;4,5-dimethyl-1H-imidazole
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2,5-dimethyl-1H-imidazole;1-methylimidazole
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2,5-dimethyl-1H-imidazole;ethyl dihydrogen phosphate
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CID 159398992
ethane;2-fluoro-5-methyl-1H-imidazole
CID 178095563
(5-methyl-1H-imidazol-2-yl)sulfanylmethanol
CID 19031058
2-methyl-5-nitroso-1H-imidazole
CID 88616226
CID 175233051
CID 175233051
2-methyl-5-propyl-1H-imidazole
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Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-1H-imidazole;hydroiodide?
The IUPAC name of 2,5-dimethyl-1H-imidazole;hydroiodide (CID 174505466) is 2,5-dimethyl-1H-imidazole;hydroiodide.
What is the SMILES notation for 2,5-dimethyl-1H-imidazole;hydroiodide?
The canonical SMILES for 2,5-dimethyl-1H-imidazole;hydroiodide is Cc1cnc(C)[nH]1.I.
What is the InChIKey of 2,5-dimethyl-1H-imidazole;hydroiodide?
The InChIKey is DJIUTIIZORPCNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N2.HI/c1-4-3-6-5(2)7-4;/h3H,1-2H3,(H,6,7);1H.
What are the key properties of 2,5-dimethyl-1H-imidazole;hydroiodide?
2,5-dimethyl-1H-imidazole;hydroiodide has a molecular weight of 224.04 g/mol, XLogP of 1.64, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-1H-imidazole;hydroiodide is sourced from PubChem (CID 174505466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).