2-(2-aminophenyl)-N-(4-bromo-2,3-dichlorophenyl)acetamide

C14H11BrCl2N2O — CID 107786724

IUPAC2-(2-aminophenyl)-N-(4-bromo-2,3-dichlorophenyl)acetamide
SMILESNc1ccccc1CC(=O)Nc1ccc(Br)c(Cl)c1Cl
InChIInChI=1S/C14H11BrCl2N2O/c15-9-5-6-11(14(17)13(9)16)19-12(20)7-8-3-1-2-4-10(8)18/h1-6H,7,18H2,(H,19,20)
InChIKeyFHUKYDPOZPNWEI-UHFFFAOYSA-N
MW374.07 g/mol
LogP4.52
Rot. Bonds3

About 2-(2-aminophenyl)-N-(4-bromo-2,3-dichlorophenyl)acetamide

2-(2-aminophenyl)-N-(4-bromo-2,3-dichlorophenyl)acetamide (PubChem CID 107786724) has the molecular formula C14H11BrCl2N2O and a molecular weight of 374.07 g/mol. Its IUPAC name is 2-(2-aminophenyl)-N-(4-bromo-2,3-dichlorophenyl)acetamide.

Molecular Properties

Compound Name2-(2-aminophenyl)-N-(4-bromo-2,3-dichlorophenyl)acetamide
PubChem CID107786724
Molecular FormulaC14H11BrCl2N2O
Molecular Weight374.07 g/mol
Exact Mass371.94
IUPAC Name2-(2-aminophenyl)-N-(4-bromo-2,3-dichlorophenyl)acetamide
SMILESNc1ccccc1CC(=O)Nc1ccc(Br)c(Cl)c1Cl
InChIInChI=1S/C14H11BrCl2N2O/c15-9-5-6-11(14(17)13(9)16)19-12(20)7-8-3-1-2-4-10(8)18/h1-6H,7,18H2,(H,19,20)
InChIKeyFHUKYDPOZPNWEI-UHFFFAOYSA-N
XLogP4.52
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.07
LogP ≤ 54.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}

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Related Compounds

2-(2-aminophenyl)-N-(5-bromo-2-chlorophenyl)acetamide
CID 55132440
2-(2-aminophenyl)-N-(2-bromo-5-fluorophenyl)acetamide
CID 103832912
N-(4-bromo-2,3-dichlorophenyl)-2-(methylamino)acetamide
CID 107790226
N-(4-bromo-2,3-dichlorophenyl)acetamide
CID 22462548
3-amino-N-(4-bromo-2,3-dichlorophenyl)pentanamide
CID 114001852
2-(2-aminophenyl)-N-(2,3-dimethylphenyl)acetamide
CID 16794842
2-(2-aminophenyl)-N-(2-cyanophenyl)acetamide
CID 16781296
N-(4-bromo-2,3-dichlorophenyl)-3-(ethylamino)propanamide
CID 107790244
4-(4-bromo-2,3-dichloroanilino)-2,2-dimethyl-4-oxobutanoic acid
CID 113428627
N-(4-amino-2-chlorophenyl)-2-(2-chlorophenyl)acetamide
CID 18069719
5-(4-bromo-2,3-dichloroanilino)-3-methyl-5-oxopentanoic acid
CID 114001552
2-(2-aminophenyl)-N-methylacetamide
CID 16772909

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminophenyl)-N-(4-bromo-2,3-dichlorophenyl)acetamide?
The IUPAC name of 2-(2-aminophenyl)-N-(4-bromo-2,3-dichlorophenyl)acetamide (CID 107786724) is 2-(2-aminophenyl)-N-(4-bromo-2,3-dichlorophenyl)acetamide.
What is the SMILES notation for 2-(2-aminophenyl)-N-(4-bromo-2,3-dichlorophenyl)acetamide?
The canonical SMILES for 2-(2-aminophenyl)-N-(4-bromo-2,3-dichlorophenyl)acetamide is Nc1ccccc1CC(=O)Nc1ccc(Br)c(Cl)c1Cl.
What is the InChIKey of 2-(2-aminophenyl)-N-(4-bromo-2,3-dichlorophenyl)acetamide?
The InChIKey is FHUKYDPOZPNWEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11BrCl2N2O/c15-9-5-6-11(14(17)13(9)16)19-12(20)7-8-3-1-2-4-10(8)18/h1-6H,7,18H2,(H,19,20).
What are the key properties of 2-(2-aminophenyl)-N-(4-bromo-2,3-dichlorophenyl)acetamide?
2-(2-aminophenyl)-N-(4-bromo-2,3-dichlorophenyl)acetamide has a molecular weight of 374.07 g/mol, XLogP of 4.52, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminophenyl)-N-(4-bromo-2,3-dichlorophenyl)acetamide is sourced from PubChem (CID 107786724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).