3,5-dichlorobenzenecarboximidamide;hydrochloride

C7H7Cl3N2 — CID 2743159

IUPAC3,5-dichlorobenzenecarboximidamide;hydrochloride
SMILESCl.[H]/N=C(\N)c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C7H6Cl2N2.ClH/c8-5-1-4(7(10)11)2-6(9)3-5;/h1-3H,(H3,10,11);1H
InChIKeyFFLPJEKRAYZAMU-UHFFFAOYSA-N
MW225.51 g/mol
LogP2.70
Rot. Bonds1

About 3,5-dichlorobenzenecarboximidamide;hydrochloride

3,5-dichlorobenzenecarboximidamide;hydrochloride (PubChem CID 2743159) has the molecular formula C7H7Cl3N2 and a molecular weight of 225.51 g/mol. Its IUPAC name is 3,5-dichlorobenzenecarboximidamide;hydrochloride.

Molecular Properties

Compound Name3,5-dichlorobenzenecarboximidamide;hydrochloride
PubChem CID2743159
Molecular FormulaC7H7Cl3N2
Molecular Weight225.51 g/mol
Exact Mass223.97
IUPAC Name3,5-dichlorobenzenecarboximidamide;hydrochloride
SMILESCl.[H]/N=C(\N)c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C7H6Cl2N2.ClH/c8-5-1-4(7(10)11)2-6(9)3-5;/h1-3H,(H3,10,11);1H
InChIKeyFFLPJEKRAYZAMU-UHFFFAOYSA-N
XLogP2.70
TPSA49.87 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.51
LogP ≤ 52.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3,5-dichlorobenzenecarboximidamide;hydrochloride?
The IUPAC name of 3,5-dichlorobenzenecarboximidamide;hydrochloride (CID 2743159) is 3,5-dichlorobenzenecarboximidamide;hydrochloride.
What is the SMILES notation for 3,5-dichlorobenzenecarboximidamide;hydrochloride?
The canonical SMILES for 3,5-dichlorobenzenecarboximidamide;hydrochloride is Cl.[H]/N=C(\N)c1cc(Cl)cc(Cl)c1.
What is the InChIKey of 3,5-dichlorobenzenecarboximidamide;hydrochloride?
The InChIKey is FFLPJEKRAYZAMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6Cl2N2.ClH/c8-5-1-4(7(10)11)2-6(9)3-5;/h1-3H,(H3,10,11);1H.
What are the key properties of 3,5-dichlorobenzenecarboximidamide;hydrochloride?
3,5-dichlorobenzenecarboximidamide;hydrochloride has a molecular weight of 225.51 g/mol, XLogP of 2.70, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichlorobenzenecarboximidamide;hydrochloride is sourced from PubChem (CID 2743159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).