2-(4-aminophenyl)-N-(2,6-dichlorophenyl)acetamide

C14H12Cl2N2O — CID 28711873

IUPAC2-(4-aminophenyl)-N-(2,6-dichlorophenyl)acetamide
SMILESNc1ccc(CC(=O)Nc2c(Cl)cccc2Cl)cc1
InChIInChI=1S/C14H12Cl2N2O/c15-11-2-1-3-12(16)14(11)18-13(19)8-9-4-6-10(17)7-5-9/h1-7H,8,17H2,(H,18,19)
InChIKeyIOSBLGSQDLORLO-UHFFFAOYSA-N
MW295.17 g/mol
LogP3.76
Rot. Bonds3

About 2-(4-aminophenyl)-N-(2,6-dichlorophenyl)acetamide

2-(4-aminophenyl)-N-(2,6-dichlorophenyl)acetamide (PubChem CID 28711873) has the molecular formula C14H12Cl2N2O and a molecular weight of 295.17 g/mol. Its IUPAC name is 2-(4-aminophenyl)-N-(2,6-dichlorophenyl)acetamide.

Molecular Properties

Compound Name2-(4-aminophenyl)-N-(2,6-dichlorophenyl)acetamide
PubChem CID28711873
Molecular FormulaC14H12Cl2N2O
Molecular Weight295.17 g/mol
Exact Mass294.03
IUPAC Name2-(4-aminophenyl)-N-(2,6-dichlorophenyl)acetamide
SMILESNc1ccc(CC(=O)Nc2c(Cl)cccc2Cl)cc1
InChIInChI=1S/C14H12Cl2N2O/c15-11-2-1-3-12(16)14(11)18-13(19)8-9-4-6-10(17)7-5-9/h1-7H,8,17H2,(H,18,19)
InChIKeyIOSBLGSQDLORLO-UHFFFAOYSA-N
XLogP3.76
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.17
LogP ≤ 53.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_no_alk(40)', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-(4-aminophenyl)-N-(2-chloro-6-methylphenyl)acetamide
CID 66253342
3-(4-aminophenyl)-N-(2,6-dichlorophenyl)propanamide
CID 28713241
N-(2-amino-6-chlorophenyl)-2-(4-chlorophenyl)acetamide
CID 62085159
2-(5-amino-2-pyridinyl)-N-(2,6-dichlorophenyl)acetamide
CID 107339031
2-(4-aminophenyl)sulfanyl-N-(2,6-dichlorophenyl)acetamide
CID 43299333
N,N'-bis(2,6-dichlorophenyl)butanediamide
CID 1010966
N-(2-chloro-6-fluorophenyl)-2-(4-sulfanylphenyl)acetamide
CID 107036138
N-[2-(2,6-dichloroanilino)-2-oxoethyl]-2-(4-methylphenyl)acetamide
CID 113001445
N-(2,6-dichlorophenyl)-2-(3-fluorophenyl)acetamide
CID 92647585
N,N'-bis(2,6-dichlorophenyl)pentanediamide
CID 1291740
N-(2,6-dichlorophenyl)-2-sulfanylacetamide
CID 14567957
2-(4-aminophenyl)-N-[3-chloro-2-(2-methoxyethoxy)phenyl]acetamide;hydrochloride
CID 86813908

Frequently Asked Questions

What is the IUPAC name of 2-(4-aminophenyl)-N-(2,6-dichlorophenyl)acetamide?
The IUPAC name of 2-(4-aminophenyl)-N-(2,6-dichlorophenyl)acetamide (CID 28711873) is 2-(4-aminophenyl)-N-(2,6-dichlorophenyl)acetamide.
What is the SMILES notation for 2-(4-aminophenyl)-N-(2,6-dichlorophenyl)acetamide?
The canonical SMILES for 2-(4-aminophenyl)-N-(2,6-dichlorophenyl)acetamide is Nc1ccc(CC(=O)Nc2c(Cl)cccc2Cl)cc1.
What is the InChIKey of 2-(4-aminophenyl)-N-(2,6-dichlorophenyl)acetamide?
The InChIKey is IOSBLGSQDLORLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12Cl2N2O/c15-11-2-1-3-12(16)14(11)18-13(19)8-9-4-6-10(17)7-5-9/h1-7H,8,17H2,(H,18,19).
What are the key properties of 2-(4-aminophenyl)-N-(2,6-dichlorophenyl)acetamide?
2-(4-aminophenyl)-N-(2,6-dichlorophenyl)acetamide has a molecular weight of 295.17 g/mol, XLogP of 3.76, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminophenyl)-N-(2,6-dichlorophenyl)acetamide is sourced from PubChem (CID 28711873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).