N-(3-amino-4-chlorophenyl)-2-(2-iodophenoxy)acetamide

C14H12ClIN2O2 — CID 43479671

IUPACN-(3-amino-4-chlorophenyl)-2-(2-iodophenoxy)acetamide
SMILESNc1cc(NC(=O)COc2ccccc2I)ccc1Cl
InChIInChI=1S/C14H12ClIN2O2/c15-10-6-5-9(7-12(10)17)18-14(19)8-20-13-4-2-1-3-11(13)16/h1-7H,8,17H2,(H,18,19)
InChIKeyIXGPEQIEZLJNAD-UHFFFAOYSA-N
MW402.62 g/mol
LogP3.54
Rot. Bonds4

About N-(3-amino-4-chlorophenyl)-2-(2-iodophenoxy)acetamide

N-(3-amino-4-chlorophenyl)-2-(2-iodophenoxy)acetamide (PubChem CID 43479671) has the molecular formula C14H12ClIN2O2 and a molecular weight of 402.62 g/mol. Its IUPAC name is N-(3-amino-4-chlorophenyl)-2-(2-iodophenoxy)acetamide.

Molecular Properties

Compound NameN-(3-amino-4-chlorophenyl)-2-(2-iodophenoxy)acetamide
PubChem CID43479671
Molecular FormulaC14H12ClIN2O2
Molecular Weight402.62 g/mol
Exact Mass401.96
IUPAC NameN-(3-amino-4-chlorophenyl)-2-(2-iodophenoxy)acetamide
SMILESNc1cc(NC(=O)COc2ccccc2I)ccc1Cl
InChIInChI=1S/C14H12ClIN2O2/c15-10-6-5-9(7-12(10)17)18-14(19)8-20-13-4-2-1-3-11(13)16/h1-7H,8,17H2,(H,18,19)
InChIKeyIXGPEQIEZLJNAD-UHFFFAOYSA-N
XLogP3.54
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.62
LogP ≤ 53.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(3-amino-4-chlorophenyl)-2-(2-fluorophenoxy)acetamide
CID 16793498
N-(3-amino-4-chlorophenyl)-2-(2-methylsulfanylphenoxy)acetamide
CID 63649159
N-(3-amino-4-chlorophenyl)-2-(2-butan-2-ylphenoxy)acetamide
CID 46735825
N-(3-amino-4-chlorophenyl)-2-(2,6-dichlorophenoxy)acetamide
CID 60800025
N-(4-fluorophenyl)-2-(2-iodophenoxy)acetamide
CID 38878179
N-(3-amino-4-chlorophenyl)-2-(4-fluorophenoxy)acetamide
CID 16788443
4-[[2-(2-iodophenoxy)acetyl]amino]benzamide
CID 38878336
2-(2-iodophenoxy)-N-(4-methyl-3-sulfamoylphenyl)acetamide
CID 38879249
N-(2-chloro-4-fluorophenyl)-2-(2-iodophenoxy)acetamide
CID 38878049
2-[2-(3,4-dichloroanilino)-2-oxoethoxy]benzoic acid
CID 4671678
2-(2-amino-4,5-dichlorophenoxy)-N-(4-fluorophenyl)acetamide
CID 107498887
2-(2-chlorophenoxy)-N-[4-chloro-3-(trifluoromethyl)phenyl]acetamide
CID 19171328

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-4-chlorophenyl)-2-(2-iodophenoxy)acetamide?
The IUPAC name of N-(3-amino-4-chlorophenyl)-2-(2-iodophenoxy)acetamide (CID 43479671) is N-(3-amino-4-chlorophenyl)-2-(2-iodophenoxy)acetamide.
What is the SMILES notation for N-(3-amino-4-chlorophenyl)-2-(2-iodophenoxy)acetamide?
The canonical SMILES for N-(3-amino-4-chlorophenyl)-2-(2-iodophenoxy)acetamide is Nc1cc(NC(=O)COc2ccccc2I)ccc1Cl.
What is the InChIKey of N-(3-amino-4-chlorophenyl)-2-(2-iodophenoxy)acetamide?
The InChIKey is IXGPEQIEZLJNAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12ClIN2O2/c15-10-6-5-9(7-12(10)17)18-14(19)8-20-13-4-2-1-3-11(13)16/h1-7H,8,17H2,(H,18,19).
What are the key properties of N-(3-amino-4-chlorophenyl)-2-(2-iodophenoxy)acetamide?
N-(3-amino-4-chlorophenyl)-2-(2-iodophenoxy)acetamide has a molecular weight of 402.62 g/mol, XLogP of 3.54, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-4-chlorophenyl)-2-(2-iodophenoxy)acetamide is sourced from PubChem (CID 43479671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).