N-(4-chloro-3-fluorophenyl)-2-iodobenzamide

C13H8ClFINO — CID 47227907

IUPACN-(4-chloro-3-fluorophenyl)-2-iodobenzamide
SMILESO=C(Nc1ccc(Cl)c(F)c1)c1ccccc1I
InChIInChI=1S/C13H8ClFINO/c14-10-6-5-8(7-11(10)15)17-13(18)9-3-1-2-4-12(9)16/h1-7H,(H,17,18)
InChIKeyGQHLYWMJOWZURU-UHFFFAOYSA-N
MW375.57 g/mol
LogP4.34
Rot. Bonds2

About N-(4-chloro-3-fluorophenyl)-2-iodobenzamide

N-(4-chloro-3-fluorophenyl)-2-iodobenzamide (PubChem CID 47227907) has the molecular formula C13H8ClFINO and a molecular weight of 375.57 g/mol. Its IUPAC name is N-(4-chloro-3-fluorophenyl)-2-iodobenzamide.

Molecular Properties

Compound NameN-(4-chloro-3-fluorophenyl)-2-iodobenzamide
PubChem CID47227907
Molecular FormulaC13H8ClFINO
Molecular Weight375.57 g/mol
Exact Mass374.93
IUPAC NameN-(4-chloro-3-fluorophenyl)-2-iodobenzamide
SMILESO=C(Nc1ccc(Cl)c(F)c1)c1ccccc1I
InChIInChI=1S/C13H8ClFINO/c14-10-6-5-8(7-11(10)15)17-13(18)9-3-1-2-4-12(9)16/h1-7H,(H,17,18)
InChIKeyGQHLYWMJOWZURU-UHFFFAOYSA-N
XLogP4.34
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.57
LogP ≤ 54.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-(3-chloro-4-fluorophenyl)-2-iodobenzamide
CID 615783
2-bromo-N-(4-chloro-3-fluorophenyl)benzamide
CID 47227901
N-(4-chloro-3-fluorophenyl)-2-iodo-3-methylbenzamide
CID 47227866
methyl 2-chloro-5-[(2-iodobenzoyl)amino]benzoate
CID 1312112
N-(3-benzamido-4-chlorophenyl)-2-iodobenzamide
CID 1104044
N-(4-chloro-3-nitrophenyl)-2-iodobenzamide
CID 3343277
N-(4-chloro-3-fluorophenyl)-2-(propan-2-ylamino)benzamide
CID 63107936
N-(4-chloro-3-fluorophenyl)-2-(ethylamino)benzamide
CID 62177542
N-[(3-chloro-4-fluorophenyl)carbamothioyl]-2-iodobenzamide
CID 2980635
N-(4-chloro-3-fluorophenyl)-1H-indole-4-carboxamide
CID 61274358
N-(3-chloro-4-pyrrolidin-1-ylphenyl)-2-iodobenzamide
CID 1220386
N-(4-chloro-3-fluorophenyl)-2-fluoro-4-hydroxybenzamide
CID 103941277

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-3-fluorophenyl)-2-iodobenzamide?
The IUPAC name of N-(4-chloro-3-fluorophenyl)-2-iodobenzamide (CID 47227907) is N-(4-chloro-3-fluorophenyl)-2-iodobenzamide.
What is the SMILES notation for N-(4-chloro-3-fluorophenyl)-2-iodobenzamide?
The canonical SMILES for N-(4-chloro-3-fluorophenyl)-2-iodobenzamide is O=C(Nc1ccc(Cl)c(F)c1)c1ccccc1I.
What is the InChIKey of N-(4-chloro-3-fluorophenyl)-2-iodobenzamide?
The InChIKey is GQHLYWMJOWZURU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8ClFINO/c14-10-6-5-8(7-11(10)15)17-13(18)9-3-1-2-4-12(9)16/h1-7H,(H,17,18).
What are the key properties of N-(4-chloro-3-fluorophenyl)-2-iodobenzamide?
N-(4-chloro-3-fluorophenyl)-2-iodobenzamide has a molecular weight of 375.57 g/mol, XLogP of 4.34, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-3-fluorophenyl)-2-iodobenzamide is sourced from PubChem (CID 47227907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).