N-(3,5-dichloro-4-hydroxyphenyl)-2-(2,5-dimethylphenyl)acetamide

C16H15Cl2NO2 — CID 82880107

IUPACN-(3,5-dichloro-4-hydroxyphenyl)-2-(2,5-dimethylphenyl)acetamide
SMILESCc1ccc(C)c(CC(=O)Nc2cc(Cl)c(O)c(Cl)c2)c1
InChIInChI=1S/C16H15Cl2NO2/c1-9-3-4-10(2)11(5-9)6-15(20)19-12-7-13(17)16(21)14(18)8-12/h3-5,7-8,21H,6H2,1-2H3,(H,19,20)
InChIKeyRXPKDTOUNVMLAZ-UHFFFAOYSA-N
MW324.21 g/mol
LogP4.50
Rot. Bonds3

About N-(3,5-dichloro-4-hydroxyphenyl)-2-(2,5-dimethylphenyl)acetamide

N-(3,5-dichloro-4-hydroxyphenyl)-2-(2,5-dimethylphenyl)acetamide (PubChem CID 82880107) has the molecular formula C16H15Cl2NO2 and a molecular weight of 324.21 g/mol. Its IUPAC name is N-(3,5-dichloro-4-hydroxyphenyl)-2-(2,5-dimethylphenyl)acetamide.

Molecular Properties

Compound NameN-(3,5-dichloro-4-hydroxyphenyl)-2-(2,5-dimethylphenyl)acetamide
PubChem CID82880107
Molecular FormulaC16H15Cl2NO2
Molecular Weight324.21 g/mol
Exact Mass323.05
IUPAC NameN-(3,5-dichloro-4-hydroxyphenyl)-2-(2,5-dimethylphenyl)acetamide
SMILESCc1ccc(C)c(CC(=O)Nc2cc(Cl)c(O)c(Cl)c2)c1
InChIInChI=1S/C16H15Cl2NO2/c1-9-3-4-10(2)11(5-9)6-15(20)19-12-7-13(17)16(21)14(18)8-12/h3-5,7-8,21H,6H2,1-2H3,(H,19,20)
InChIKeyRXPKDTOUNVMLAZ-UHFFFAOYSA-N
XLogP4.50
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.21
LogP ≤ 54.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(3-amino-4-chlorophenyl)-2-(2,5-dimethylphenyl)acetamide
CID 62537999
2-(2,5-dimethylphenyl)-N-(3-hydroxy-4-methylphenyl)acetamide
CID 64793457
2-(2,5-dimethylphenyl)-N-(3-hydroxyphenyl)acetamide
CID 55087243
2-(2,5-dimethylphenyl)-N-(2,4,6-trimethylphenyl)acetamide
CID 38020341
N-(3,5-dichloro-4-hydroxyphenyl)-2,4-dimethylbenzamide
CID 82884847
N-(3-chloro-4-methylphenyl)-2-(2-hydroxyphenyl)acetamide
CID 60615922
N-(3,5-dichloro-4-hydroxyphenyl)-3-(3-methylphenyl)propanamide
CID 82881123
N-[3-(aminomethyl)-4-fluorophenyl]-2-(2,5-dimethylphenyl)acetamide
CID 62537171
N-(3,5-dichloro-4-hydroxyphenyl)-2-(2,6-difluorophenyl)acetamide
CID 82880113
2-(2,4-dimethylphenyl)-N-(4-methylphenyl)acetamide
CID 7596977
5-chloro-N-(3,5-dichloro-4-hydroxyphenyl)-2-methylbenzamide
CID 82885279
ethyl 3-[[2-(2,5-dimethylphenyl)acetyl]amino]benzoate
CID 38005419

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dichloro-4-hydroxyphenyl)-2-(2,5-dimethylphenyl)acetamide?
The IUPAC name of N-(3,5-dichloro-4-hydroxyphenyl)-2-(2,5-dimethylphenyl)acetamide (CID 82880107) is N-(3,5-dichloro-4-hydroxyphenyl)-2-(2,5-dimethylphenyl)acetamide.
What is the SMILES notation for N-(3,5-dichloro-4-hydroxyphenyl)-2-(2,5-dimethylphenyl)acetamide?
The canonical SMILES for N-(3,5-dichloro-4-hydroxyphenyl)-2-(2,5-dimethylphenyl)acetamide is Cc1ccc(C)c(CC(=O)Nc2cc(Cl)c(O)c(Cl)c2)c1.
What is the InChIKey of N-(3,5-dichloro-4-hydroxyphenyl)-2-(2,5-dimethylphenyl)acetamide?
The InChIKey is RXPKDTOUNVMLAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15Cl2NO2/c1-9-3-4-10(2)11(5-9)6-15(20)19-12-7-13(17)16(21)14(18)8-12/h3-5,7-8,21H,6H2,1-2H3,(H,19,20).
What are the key properties of N-(3,5-dichloro-4-hydroxyphenyl)-2-(2,5-dimethylphenyl)acetamide?
N-(3,5-dichloro-4-hydroxyphenyl)-2-(2,5-dimethylphenyl)acetamide has a molecular weight of 324.21 g/mol, XLogP of 4.50, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dichloro-4-hydroxyphenyl)-2-(2,5-dimethylphenyl)acetamide is sourced from PubChem (CID 82880107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).