2-(3,5-dichlorophenoxy)-N-(4-iodo-2-methylphenyl)acetamide

C15H12Cl2INO2 — CID 18281064

IUPAC2-(3,5-dichlorophenoxy)-N-(4-iodo-2-methylphenyl)acetamide
SMILESCc1cc(I)ccc1NC(=O)COc1cc(Cl)cc(Cl)c1
InChIInChI=1S/C15H12Cl2INO2/c1-9-4-12(18)2-3-14(9)19-15(20)8-21-13-6-10(16)5-11(17)7-13/h2-7H,8H2,1H3,(H,19,20)
InChIKeyNDHKDWUTAZHIHK-UHFFFAOYSA-N
MW436.08 g/mol
LogP4.92
Rot. Bonds4

About 2-(3,5-dichlorophenoxy)-N-(4-iodo-2-methylphenyl)acetamide

2-(3,5-dichlorophenoxy)-N-(4-iodo-2-methylphenyl)acetamide (PubChem CID 18281064) has the molecular formula C15H12Cl2INO2 and a molecular weight of 436.08 g/mol. Its IUPAC name is 2-(3,5-dichlorophenoxy)-N-(4-iodo-2-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(3,5-dichlorophenoxy)-N-(4-iodo-2-methylphenyl)acetamide
PubChem CID18281064
Molecular FormulaC15H12Cl2INO2
Molecular Weight436.08 g/mol
Exact Mass434.93
IUPAC Name2-(3,5-dichlorophenoxy)-N-(4-iodo-2-methylphenyl)acetamide
SMILESCc1cc(I)ccc1NC(=O)COc1cc(Cl)cc(Cl)c1
InChIInChI=1S/C15H12Cl2INO2/c1-9-4-12(18)2-3-14(9)19-15(20)8-21-13-6-10(16)5-11(17)7-13/h2-7H,8H2,1H3,(H,19,20)
InChIKeyNDHKDWUTAZHIHK-UHFFFAOYSA-N
XLogP4.92
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500436.08
LogP ≤ 54.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(4-chloro-2-methylphenyl)-2-(3,5-dichlorophenoxy)acetamide
CID 7467092
N-(4-chloro-2-methylphenyl)-2-(3,5-dimethylphenoxy)acetamide
CID 7784194
N-(4-chloro-2-methylphenyl)-2-(3-chlorophenoxy)acetamide
CID 2707661
N-(4-amino-2-methylphenyl)-2-(4-iodophenoxy)acetamide
CID 43144731
2-[4-[[2-(4-iodophenoxy)acetyl]amino]-3-methylphenoxy]acetic acid
CID 17342102
2-(1,3-benzodioxol-5-yloxy)-N-(4-iodo-2-methylphenyl)acetamide
CID 7894440
N-(4-iodo-2-methylphenyl)-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112604433
2-[2-(4-iodo-2-methylanilino)-2-oxoethoxy]acetic acid
CID 60708310
N-(4-iodo-2-methylphenyl)-2-(3-nitrophenoxy)acetamide
CID 7865526
N-(4-chloro-2-methylphenyl)-2-(3,4-dimethylphenoxy)acetamide
CID 1122557
2-(3,5-dichlorophenoxy)-N-(2,4-dimethoxyphenyl)acetamide
CID 7467088
N-(4-chloro-2-methylphenyl)-2-[4-(4-methylphenyl)phenoxy]acetamide
CID 19174143

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dichlorophenoxy)-N-(4-iodo-2-methylphenyl)acetamide?
The IUPAC name of 2-(3,5-dichlorophenoxy)-N-(4-iodo-2-methylphenyl)acetamide (CID 18281064) is 2-(3,5-dichlorophenoxy)-N-(4-iodo-2-methylphenyl)acetamide.
What is the SMILES notation for 2-(3,5-dichlorophenoxy)-N-(4-iodo-2-methylphenyl)acetamide?
The canonical SMILES for 2-(3,5-dichlorophenoxy)-N-(4-iodo-2-methylphenyl)acetamide is Cc1cc(I)ccc1NC(=O)COc1cc(Cl)cc(Cl)c1.
What is the InChIKey of 2-(3,5-dichlorophenoxy)-N-(4-iodo-2-methylphenyl)acetamide?
The InChIKey is NDHKDWUTAZHIHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12Cl2INO2/c1-9-4-12(18)2-3-14(9)19-15(20)8-21-13-6-10(16)5-11(17)7-13/h2-7H,8H2,1H3,(H,19,20).
What are the key properties of 2-(3,5-dichlorophenoxy)-N-(4-iodo-2-methylphenyl)acetamide?
2-(3,5-dichlorophenoxy)-N-(4-iodo-2-methylphenyl)acetamide has a molecular weight of 436.08 g/mol, XLogP of 4.92, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dichlorophenoxy)-N-(4-iodo-2-methylphenyl)acetamide is sourced from PubChem (CID 18281064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).