N-(5-bromo-2-chlorophenyl)-2-(2-nitrophenyl)acetamide

C14H10BrClN2O3 — CID 62909951

IUPACN-(5-bromo-2-chlorophenyl)-2-(2-nitrophenyl)acetamide
SMILESO=C(Cc1ccccc1[N+](=O)[O-])Nc1cc(Br)ccc1Cl
InChIInChI=1S/C14H10BrClN2O3/c15-10-5-6-11(16)12(8-10)17-14(19)7-9-3-1-2-4-13(9)18(20)21/h1-6,8H,7H2,(H,17,19)
InChIKeyALHBEVGXTYOMBR-UHFFFAOYSA-N
MW369.60 g/mol
LogP4.19
Rot. Bonds4

About N-(5-bromo-2-chlorophenyl)-2-(2-nitrophenyl)acetamide

N-(5-bromo-2-chlorophenyl)-2-(2-nitrophenyl)acetamide (PubChem CID 62909951) has the molecular formula C14H10BrClN2O3 and a molecular weight of 369.60 g/mol. Its IUPAC name is N-(5-bromo-2-chlorophenyl)-2-(2-nitrophenyl)acetamide.

Molecular Properties

Compound NameN-(5-bromo-2-chlorophenyl)-2-(2-nitrophenyl)acetamide
PubChem CID62909951
Molecular FormulaC14H10BrClN2O3
Molecular Weight369.60 g/mol
Exact Mass367.96
IUPAC NameN-(5-bromo-2-chlorophenyl)-2-(2-nitrophenyl)acetamide
SMILESO=C(Cc1ccccc1[N+](=O)[O-])Nc1cc(Br)ccc1Cl
InChIInChI=1S/C14H10BrClN2O3/c15-10-5-6-11(16)12(8-10)17-14(19)7-9-3-1-2-4-13(9)18(20)21/h1-6,8H,7H2,(H,17,19)
InChIKeyALHBEVGXTYOMBR-UHFFFAOYSA-N
XLogP4.19
TPSA72.24 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.60
LogP ≤ 54.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-(5-bromo-2-chlorophenyl)-2-(2-nitrophenyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(2-aminophenyl)-N-(5-bromo-2-chlorophenyl)acetamide
CID 55132440
1-(5-bromo-2-chlorophenyl)-2-(2-nitrophenyl)ethanone
CID 61056069
N-(2-bromophenyl)-2-(2-nitrophenyl)acetamide
CID 885126
1-(4-bromo-2-chlorophenyl)-2-(2-nitrophenyl)ethanone
CID 61055886
N-(4-chloro-2,5-dimethoxyphenyl)-2-(2-nitrophenyl)acetamide
CID 1351291
2-amino-N-(5-bromo-2-chlorophenyl)-3-nitrobenzamide
CID 115678920
N-(5-bromo-2-chlorophenyl)-4-chloro-3-nitrobenzamide
CID 62908558
N-(3-chloro-4-methylphenyl)-2-(2-nitrophenyl)acetamide
CID 3384920
4-chloro-N-[2-[[2-(2-nitrophenyl)acetyl]amino]phenyl]benzamide
CID 31969807
5-bromo-2-chloro-N-[(2-chloro-6-nitrophenyl)methyl]aniline
CID 63745465
2-(2-nitrophenyl)-N-(2-phenylphenyl)acetamide
CID 888362
N-(2-benzylphenyl)-2-(2-nitrophenyl)acetamide
CID 26880181

Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-2-chlorophenyl)-2-(2-nitrophenyl)acetamide?
The IUPAC name of N-(5-bromo-2-chlorophenyl)-2-(2-nitrophenyl)acetamide (CID 62909951) is N-(5-bromo-2-chlorophenyl)-2-(2-nitrophenyl)acetamide.
What is the SMILES notation for N-(5-bromo-2-chlorophenyl)-2-(2-nitrophenyl)acetamide?
The canonical SMILES for N-(5-bromo-2-chlorophenyl)-2-(2-nitrophenyl)acetamide is O=C(Cc1ccccc1[N+](=O)[O-])Nc1cc(Br)ccc1Cl.
What is the InChIKey of N-(5-bromo-2-chlorophenyl)-2-(2-nitrophenyl)acetamide?
The InChIKey is ALHBEVGXTYOMBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10BrClN2O3/c15-10-5-6-11(16)12(8-10)17-14(19)7-9-3-1-2-4-13(9)18(20)21/h1-6,8H,7H2,(H,17,19).
What are the key properties of N-(5-bromo-2-chlorophenyl)-2-(2-nitrophenyl)acetamide?
N-(5-bromo-2-chlorophenyl)-2-(2-nitrophenyl)acetamide has a molecular weight of 369.60 g/mol, XLogP of 4.19, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-2-chlorophenyl)-2-(2-nitrophenyl)acetamide is sourced from PubChem (CID 62909951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).