2-(3-bromoanilino)-N-(4-chlorophenyl)acetamide

C14H12BrClN2O — CID 9080372

IUPAC2-(3-bromoanilino)-N-(4-chlorophenyl)acetamide
SMILESO=C(CNc1cccc(Br)c1)Nc1ccc(Cl)cc1
InChIInChI=1S/C14H12BrClN2O/c15-10-2-1-3-13(8-10)17-9-14(19)18-12-6-4-11(16)5-7-12/h1-8,17H,9H2,(H,18,19)
InChIKeyDYJUVUOCXYXBST-UHFFFAOYSA-N
MW339.62 g/mol
LogP4.15
Rot. Bonds4

About 2-(3-bromoanilino)-N-(4-chlorophenyl)acetamide

2-(3-bromoanilino)-N-(4-chlorophenyl)acetamide (PubChem CID 9080372) has the molecular formula C14H12BrClN2O and a molecular weight of 339.62 g/mol. Its IUPAC name is 2-(3-bromoanilino)-N-(4-chlorophenyl)acetamide.

Molecular Properties

Compound Name2-(3-bromoanilino)-N-(4-chlorophenyl)acetamide
PubChem CID9080372
Molecular FormulaC14H12BrClN2O
Molecular Weight339.62 g/mol
Exact Mass337.98
IUPAC Name2-(3-bromoanilino)-N-(4-chlorophenyl)acetamide
SMILESO=C(CNc1cccc(Br)c1)Nc1ccc(Cl)cc1
InChIInChI=1S/C14H12BrClN2O/c15-10-2-1-3-13(8-10)17-9-14(19)18-12-6-4-11(16)5-7-12/h1-8,17H,9H2,(H,18,19)
InChIKeyDYJUVUOCXYXBST-UHFFFAOYSA-N
XLogP4.15
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.62
LogP ≤ 54.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-bromoanilino)-N-(4-iodophenyl)acetamide
CID 26416177
4-[[2-(3-bromoanilino)acetyl]amino]benzamide
CID 46633398
2-(4-bromoanilino)-N-(3-bromophenyl)acetamide
CID 7492464
methyl 4-[[2-(3-bromoanilino)acetyl]amino]benzoate
CID 603629
2-(2-bromo-5-chloroanilino)-N-(3-bromophenyl)acetamide
CID 81281124
2-(2-bromo-4-chloroanilino)-N-(3-bromophenyl)acetamide
CID 81271166
N'-(3-bromophenyl)-N-(4-chlorophenyl)oxamide
CID 108516651
N-tert-butyl-3-[[2-(4-chloroanilino)-2-oxoethyl]amino]benzamide
CID 54844566
N-(4-chlorophenyl)-2-(3,4-dichloroanilino)acetamide
CID 29294726
2-(5-bromo-2-chloroanilino)-N-(4-chlorophenyl)acetamide
CID 63492462
N-(3-acetylphenyl)-2-(4-chloroanilino)acetamide
CID 26506544
2-(3-bromoanilino)-N-(2-chloro-4-methylphenyl)acetamide
CID 9080359

Frequently Asked Questions

What is the IUPAC name of 2-(3-bromoanilino)-N-(4-chlorophenyl)acetamide?
The IUPAC name of 2-(3-bromoanilino)-N-(4-chlorophenyl)acetamide (CID 9080372) is 2-(3-bromoanilino)-N-(4-chlorophenyl)acetamide.
What is the SMILES notation for 2-(3-bromoanilino)-N-(4-chlorophenyl)acetamide?
The canonical SMILES for 2-(3-bromoanilino)-N-(4-chlorophenyl)acetamide is O=C(CNc1cccc(Br)c1)Nc1ccc(Cl)cc1.
What is the InChIKey of 2-(3-bromoanilino)-N-(4-chlorophenyl)acetamide?
The InChIKey is DYJUVUOCXYXBST-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12BrClN2O/c15-10-2-1-3-13(8-10)17-9-14(19)18-12-6-4-11(16)5-7-12/h1-8,17H,9H2,(H,18,19).
What are the key properties of 2-(3-bromoanilino)-N-(4-chlorophenyl)acetamide?
2-(3-bromoanilino)-N-(4-chlorophenyl)acetamide has a molecular weight of 339.62 g/mol, XLogP of 4.15, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-bromoanilino)-N-(4-chlorophenyl)acetamide is sourced from PubChem (CID 9080372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).