3,5-diiodopyridine-2-carboximidamide;hydrochloride

C6H6ClI2N3 — CID 133057044

IUPAC3,5-diiodopyridine-2-carboximidamide;hydrochloride
SMILESCl.[H]/N=C(\N)c1ncc(I)cc1I
InChIInChI=1S/C6H5I2N3.ClH/c7-3-1-4(8)5(6(9)10)11-2-3;/h1-2H,(H3,9,10);1H
InChIKeyGNTLQTANGDCJLC-UHFFFAOYSA-N
MW409.40 g/mol
LogP2.00
Rot. Bonds1

About 3,5-diiodopyridine-2-carboximidamide;hydrochloride

3,5-diiodopyridine-2-carboximidamide;hydrochloride (PubChem CID 133057044) has the molecular formula C6H6ClI2N3 and a molecular weight of 409.40 g/mol. Its IUPAC name is 3,5-diiodopyridine-2-carboximidamide;hydrochloride.

Molecular Properties

Compound Name3,5-diiodopyridine-2-carboximidamide;hydrochloride
PubChem CID133057044
Molecular FormulaC6H6ClI2N3
Molecular Weight409.40 g/mol
Exact Mass408.83
IUPAC Name3,5-diiodopyridine-2-carboximidamide;hydrochloride
SMILESCl.[H]/N=C(\N)c1ncc(I)cc1I
InChIInChI=1S/C6H5I2N3.ClH/c7-3-1-4(8)5(6(9)10)11-2-3;/h1-2H,(H3,9,10);1H
InChIKeyGNTLQTANGDCJLC-UHFFFAOYSA-N
XLogP2.00
TPSA62.76 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500409.40
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

Analyze 3,5-diiodopyridine-2-carboximidamide;hydrochloride 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

3-bromo-5-iodopyridine-2-carboximidamide
CID 133055702
5-iodopyridine-3-carboximidamide
CID 74892022
3,5-dimethylpyridine-2-carboximidamide
CID 112703746
3,6-dimethylpyrazine-2-carboximidamide;hydrochloride
CID 122129858
4-(2-carbamimidoyl-4-pyridinyl)pyridine-2-carboximidamide;dihydrochloride
CID 19988643
(3,5-diiodo-2-pyridinyl)methanol
CID 133054700
2-aminopyrimidine-5-carboximidamide
CID 45080078
5-amino-1-methyltriazole-4-carboximidamide;hydrochloride
CID 136981735
3-methyltriazole-4-carboximidamide;hydrochloride
CID 175806610
3,4-difluoropyridine-2-carboximidamide
CID 137371718
5-iodo-3-(trifluoromethyl)pyridine-2-carboxylic acid
CID 130784436
isoquinoline-3-carboximidamide
CID 5069411

Frequently Asked Questions

What is the IUPAC name of 3,5-diiodopyridine-2-carboximidamide;hydrochloride?
The IUPAC name of 3,5-diiodopyridine-2-carboximidamide;hydrochloride (CID 133057044) is 3,5-diiodopyridine-2-carboximidamide;hydrochloride.
What is the SMILES notation for 3,5-diiodopyridine-2-carboximidamide;hydrochloride?
The canonical SMILES for 3,5-diiodopyridine-2-carboximidamide;hydrochloride is Cl.[H]/N=C(\N)c1ncc(I)cc1I.
What is the InChIKey of 3,5-diiodopyridine-2-carboximidamide;hydrochloride?
The InChIKey is GNTLQTANGDCJLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5I2N3.ClH/c7-3-1-4(8)5(6(9)10)11-2-3;/h1-2H,(H3,9,10);1H.
What are the key properties of 3,5-diiodopyridine-2-carboximidamide;hydrochloride?
3,5-diiodopyridine-2-carboximidamide;hydrochloride has a molecular weight of 409.40 g/mol, XLogP of 2.00, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-diiodopyridine-2-carboximidamide;hydrochloride is sourced from PubChem (CID 133057044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).