N'-(4-chloro-2-iodophenyl)cyclopropanecarboximidamide

C10H10ClIN2 — CID 107638264

IUPACN'-(4-chloro-2-iodophenyl)cyclopropanecarboximidamide
SMILESN/C(=N\c1ccc(Cl)cc1I)C1CC1
InChIInChI=1S/C10H10ClIN2/c11-7-3-4-9(8(12)5-7)14-10(13)6-1-2-6/h3-6H,1-2H2,(H2,13,14)
InChIKeyFLYGJZYPNQOACV-UHFFFAOYSA-N
MW320.56 g/mol
LogP3.34
Rot. Bonds2

About N'-(4-chloro-2-iodophenyl)cyclopropanecarboximidamide

N'-(4-chloro-2-iodophenyl)cyclopropanecarboximidamide (PubChem CID 107638264) has the molecular formula C10H10ClIN2 and a molecular weight of 320.56 g/mol. Its IUPAC name is N'-(4-chloro-2-iodophenyl)cyclopropanecarboximidamide.

Molecular Properties

Compound NameN'-(4-chloro-2-iodophenyl)cyclopropanecarboximidamide
PubChem CID107638264
Molecular FormulaC10H10ClIN2
Molecular Weight320.56 g/mol
Exact Mass319.96
IUPAC NameN'-(4-chloro-2-iodophenyl)cyclopropanecarboximidamide
SMILESN/C(=N\c1ccc(Cl)cc1I)C1CC1
InChIInChI=1S/C10H10ClIN2/c11-7-3-4-9(8(12)5-7)14-10(13)6-1-2-6/h3-6H,1-2H2,(H2,13,14)
InChIKeyFLYGJZYPNQOACV-UHFFFAOYSA-N
XLogP3.34
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.56
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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'}

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Frequently Asked Questions

What is the IUPAC name of N'-(4-chloro-2-iodophenyl)cyclopropanecarboximidamide?
The IUPAC name of N'-(4-chloro-2-iodophenyl)cyclopropanecarboximidamide (CID 107638264) is N'-(4-chloro-2-iodophenyl)cyclopropanecarboximidamide.
What is the SMILES notation for N'-(4-chloro-2-iodophenyl)cyclopropanecarboximidamide?
The canonical SMILES for N'-(4-chloro-2-iodophenyl)cyclopropanecarboximidamide is N/C(=N\c1ccc(Cl)cc1I)C1CC1.
What is the InChIKey of N'-(4-chloro-2-iodophenyl)cyclopropanecarboximidamide?
The InChIKey is FLYGJZYPNQOACV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10ClIN2/c11-7-3-4-9(8(12)5-7)14-10(13)6-1-2-6/h3-6H,1-2H2,(H2,13,14).
What are the key properties of N'-(4-chloro-2-iodophenyl)cyclopropanecarboximidamide?
N'-(4-chloro-2-iodophenyl)cyclopropanecarboximidamide has a molecular weight of 320.56 g/mol, XLogP of 3.34, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-chloro-2-iodophenyl)cyclopropanecarboximidamide is sourced from PubChem (CID 107638264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).