2-(3-aminophenyl)-N-(3,5-dichlorophenyl)acetamide

C14H12Cl2N2O — CID 28712382

IUPAC2-(3-aminophenyl)-N-(3,5-dichlorophenyl)acetamide
SMILESNc1cccc(CC(=O)Nc2cc(Cl)cc(Cl)c2)c1
InChIInChI=1S/C14H12Cl2N2O/c15-10-6-11(16)8-13(7-10)18-14(19)5-9-2-1-3-12(17)4-9/h1-4,6-8H,5,17H2,(H,18,19)
InChIKeyCJDFGAOFVXKOIA-UHFFFAOYSA-N
MW295.17 g/mol
LogP3.76
Rot. Bonds3

About 2-(3-aminophenyl)-N-(3,5-dichlorophenyl)acetamide

2-(3-aminophenyl)-N-(3,5-dichlorophenyl)acetamide (PubChem CID 28712382) has the molecular formula C14H12Cl2N2O and a molecular weight of 295.17 g/mol. Its IUPAC name is 2-(3-aminophenyl)-N-(3,5-dichlorophenyl)acetamide.

Molecular Properties

Compound Name2-(3-aminophenyl)-N-(3,5-dichlorophenyl)acetamide
PubChem CID28712382
Molecular FormulaC14H12Cl2N2O
Molecular Weight295.17 g/mol
Exact Mass294.03
IUPAC Name2-(3-aminophenyl)-N-(3,5-dichlorophenyl)acetamide
SMILESNc1cccc(CC(=O)Nc2cc(Cl)cc(Cl)c2)c1
InChIInChI=1S/C14H12Cl2N2O/c15-10-6-11(16)8-13(7-10)18-14(19)5-9-2-1-3-12(17)4-9/h1-4,6-8H,5,17H2,(H,18,19)
InChIKeyCJDFGAOFVXKOIA-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': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-(3-aminophenyl)-N-(3,5-dichloro-4-fluorophenyl)acetamide
CID 107571211
2-(3-aminophenyl)-N-(2,3-dichlorophenyl)acetamide
CID 28712388
2-(3-aminophenyl)-N-(3-chloro-4-methoxyphenyl)acetamide
CID 28712195
2-(3-aminophenyl)-N-[4-(trifluoromethyl)phenyl]acetamide
CID 28712241
2-(3-aminophenyl)-N-(4-chloro-3-pyridinyl)acetamide
CID 83164175
3-(3-aminophenoxy)-N-(3,5-dichlorophenyl)propanamide
CID 61090468
2-(3-aminophenyl)-N-[4-(diethylamino)phenyl]acetamide
CID 28712277
4-[[2-(3-aminophenyl)acetyl]amino]-N-methylbenzamide
CID 62499837
N-(3,5-dichlorophenyl)-2-(3,4-dimethoxyphenyl)acetamide
CID 3482890
N-[(3-aminophenyl)methyl]-3,5-dichlorobenzamide
CID 62499613
N-(3-chlorophenyl)-2-(3-methylphenyl)acetamide
CID 9497443
2-(3-aminophenyl)-N-(4-piperidin-1-ylphenyl)acetamide
CID 28712283

Frequently Asked Questions

What is the IUPAC name of 2-(3-aminophenyl)-N-(3,5-dichlorophenyl)acetamide?
The IUPAC name of 2-(3-aminophenyl)-N-(3,5-dichlorophenyl)acetamide (CID 28712382) is 2-(3-aminophenyl)-N-(3,5-dichlorophenyl)acetamide.
What is the SMILES notation for 2-(3-aminophenyl)-N-(3,5-dichlorophenyl)acetamide?
The canonical SMILES for 2-(3-aminophenyl)-N-(3,5-dichlorophenyl)acetamide is Nc1cccc(CC(=O)Nc2cc(Cl)cc(Cl)c2)c1.
What is the InChIKey of 2-(3-aminophenyl)-N-(3,5-dichlorophenyl)acetamide?
The InChIKey is CJDFGAOFVXKOIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12Cl2N2O/c15-10-6-11(16)8-13(7-10)18-14(19)5-9-2-1-3-12(17)4-9/h1-4,6-8H,5,17H2,(H,18,19).
What are the key properties of 2-(3-aminophenyl)-N-(3,5-dichlorophenyl)acetamide?
2-(3-aminophenyl)-N-(3,5-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-(3-aminophenyl)-N-(3,5-dichlorophenyl)acetamide is sourced from PubChem (CID 28712382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).