N-(2,3-dichlorophenyl)-2-(4-iodophenoxy)acetamide

C14H10Cl2INO2 — CID 55325965

IUPACN-(2,3-dichlorophenyl)-2-(4-iodophenoxy)acetamide
SMILESO=C(COc1ccc(I)cc1)Nc1cccc(Cl)c1Cl
InChIInChI=1S/C14H10Cl2INO2/c15-11-2-1-3-12(14(11)16)18-13(19)8-20-10-6-4-9(17)5-7-10/h1-7H,8H2,(H,18,19)
InChIKeyUOTMOCWKOJWOLG-UHFFFAOYSA-N
MW422.05 g/mol
LogP4.62
Rot. Bonds4

About N-(2,3-dichlorophenyl)-2-(4-iodophenoxy)acetamide

N-(2,3-dichlorophenyl)-2-(4-iodophenoxy)acetamide (PubChem CID 55325965) has the molecular formula C14H10Cl2INO2 and a molecular weight of 422.05 g/mol. Its IUPAC name is N-(2,3-dichlorophenyl)-2-(4-iodophenoxy)acetamide.

Molecular Properties

Compound NameN-(2,3-dichlorophenyl)-2-(4-iodophenoxy)acetamide
PubChem CID55325965
Molecular FormulaC14H10Cl2INO2
Molecular Weight422.05 g/mol
Exact Mass420.91
IUPAC NameN-(2,3-dichlorophenyl)-2-(4-iodophenoxy)acetamide
SMILESO=C(COc1ccc(I)cc1)Nc1cccc(Cl)c1Cl
InChIInChI=1S/C14H10Cl2INO2/c15-11-2-1-3-12(14(11)16)18-13(19)8-20-10-6-4-9(17)5-7-10/h1-7H,8H2,(H,18,19)
InChIKeyUOTMOCWKOJWOLG-UHFFFAOYSA-N
XLogP4.62
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.05
LogP ≤ 54.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(2,3-dichlorophenyl)-2-(4-iodophenoxy)acetamide?
The IUPAC name of N-(2,3-dichlorophenyl)-2-(4-iodophenoxy)acetamide (CID 55325965) is N-(2,3-dichlorophenyl)-2-(4-iodophenoxy)acetamide.
What is the SMILES notation for N-(2,3-dichlorophenyl)-2-(4-iodophenoxy)acetamide?
The canonical SMILES for N-(2,3-dichlorophenyl)-2-(4-iodophenoxy)acetamide is O=C(COc1ccc(I)cc1)Nc1cccc(Cl)c1Cl.
What is the InChIKey of N-(2,3-dichlorophenyl)-2-(4-iodophenoxy)acetamide?
The InChIKey is UOTMOCWKOJWOLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10Cl2INO2/c15-11-2-1-3-12(14(11)16)18-13(19)8-20-10-6-4-9(17)5-7-10/h1-7H,8H2,(H,18,19).
What are the key properties of N-(2,3-dichlorophenyl)-2-(4-iodophenoxy)acetamide?
N-(2,3-dichlorophenyl)-2-(4-iodophenoxy)acetamide has a molecular weight of 422.05 g/mol, XLogP of 4.62, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dichlorophenyl)-2-(4-iodophenoxy)acetamide is sourced from PubChem (CID 55325965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).