2-(4-chlorophenyl)-N-(3-fluoro-2-iodophenyl)acetamide

C14H10ClFINO — CID 113340918

IUPAC2-(4-chlorophenyl)-N-(3-fluoro-2-iodophenyl)acetamide
SMILESO=C(Cc1ccc(Cl)cc1)Nc1cccc(F)c1I
InChIInChI=1S/C14H10ClFINO/c15-10-6-4-9(5-7-10)8-13(19)18-12-3-1-2-11(16)14(12)17/h1-7H,8H2,(H,18,19)
InChIKeyUFYLDHVRCAZNDV-UHFFFAOYSA-N
MW389.60 g/mol
LogP4.26
Rot. Bonds3

About 2-(4-chlorophenyl)-N-(3-fluoro-2-iodophenyl)acetamide

2-(4-chlorophenyl)-N-(3-fluoro-2-iodophenyl)acetamide (PubChem CID 113340918) has the molecular formula C14H10ClFINO and a molecular weight of 389.60 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-N-(3-fluoro-2-iodophenyl)acetamide.

Molecular Properties

Compound Name2-(4-chlorophenyl)-N-(3-fluoro-2-iodophenyl)acetamide
PubChem CID113340918
Molecular FormulaC14H10ClFINO
Molecular Weight389.60 g/mol
Exact Mass388.95
IUPAC Name2-(4-chlorophenyl)-N-(3-fluoro-2-iodophenyl)acetamide
SMILESO=C(Cc1ccc(Cl)cc1)Nc1cccc(F)c1I
InChIInChI=1S/C14H10ClFINO/c15-10-6-4-9(5-7-10)8-13(19)18-12-3-1-2-11(16)14(12)17/h1-7H,8H2,(H,18,19)
InChIKeyUFYLDHVRCAZNDV-UHFFFAOYSA-N
XLogP4.26
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.60
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-N-(3-fluoro-2-iodophenyl)acetamide?
The IUPAC name of 2-(4-chlorophenyl)-N-(3-fluoro-2-iodophenyl)acetamide (CID 113340918) is 2-(4-chlorophenyl)-N-(3-fluoro-2-iodophenyl)acetamide.
What is the SMILES notation for 2-(4-chlorophenyl)-N-(3-fluoro-2-iodophenyl)acetamide?
The canonical SMILES for 2-(4-chlorophenyl)-N-(3-fluoro-2-iodophenyl)acetamide is O=C(Cc1ccc(Cl)cc1)Nc1cccc(F)c1I.
What is the InChIKey of 2-(4-chlorophenyl)-N-(3-fluoro-2-iodophenyl)acetamide?
The InChIKey is UFYLDHVRCAZNDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10ClFINO/c15-10-6-4-9(5-7-10)8-13(19)18-12-3-1-2-11(16)14(12)17/h1-7H,8H2,(H,18,19).
What are the key properties of 2-(4-chlorophenyl)-N-(3-fluoro-2-iodophenyl)acetamide?
2-(4-chlorophenyl)-N-(3-fluoro-2-iodophenyl)acetamide has a molecular weight of 389.60 g/mol, XLogP of 4.26, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-N-(3-fluoro-2-iodophenyl)acetamide is sourced from PubChem (CID 113340918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).