2-(4-bromo-2-chloroanilino)-N-(2-methoxy-5-methylphenyl)acetamide

C16H16BrClN2O2 — CID 33169745

IUPAC2-(4-bromo-2-chloroanilino)-N-(2-methoxy-5-methylphenyl)acetamide
SMILESCOc1ccc(C)cc1NC(=O)CNc1ccc(Br)cc1Cl
InChIInChI=1S/C16H16BrClN2O2/c1-10-3-6-15(22-2)14(7-10)20-16(21)9-19-13-5-4-11(17)8-12(13)18/h3-8,19H,9H2,1-2H3,(H,20,21)
InChIKeyNHLZQDDLYHHBDU-UHFFFAOYSA-N
MW383.67 g/mol
LogP4.47
Rot. Bonds5

About 2-(4-bromo-2-chloroanilino)-N-(2-methoxy-5-methylphenyl)acetamide

2-(4-bromo-2-chloroanilino)-N-(2-methoxy-5-methylphenyl)acetamide (PubChem CID 33169745) has the molecular formula C16H16BrClN2O2 and a molecular weight of 383.67 g/mol. Its IUPAC name is 2-(4-bromo-2-chloroanilino)-N-(2-methoxy-5-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(4-bromo-2-chloroanilino)-N-(2-methoxy-5-methylphenyl)acetamide
PubChem CID33169745
Molecular FormulaC16H16BrClN2O2
Molecular Weight383.67 g/mol
Exact Mass382.01
IUPAC Name2-(4-bromo-2-chloroanilino)-N-(2-methoxy-5-methylphenyl)acetamide
SMILESCOc1ccc(C)cc1NC(=O)CNc1ccc(Br)cc1Cl
InChIInChI=1S/C16H16BrClN2O2/c1-10-3-6-15(22-2)14(7-10)20-16(21)9-19-13-5-4-11(17)8-12(13)18/h3-8,19H,9H2,1-2H3,(H,20,21)
InChIKeyNHLZQDDLYHHBDU-UHFFFAOYSA-N
XLogP4.47
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.67
LogP ≤ 54.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,4-dichloroanilino)-N-(2-methoxy-5-methylphenyl)acetamide
CID 26417516
2-(2-chloro-4-methylanilino)-N-(2-methoxy-5-nitrophenyl)acetamide
CID 9099396
2-(3-chloro-2-methylanilino)-N-(2-methoxy-5-methylphenyl)acetamide
CID 9099219
2-(3,4-dichloroanilino)-N-(2-methoxy-5-methylphenyl)acetamide
CID 9098774
5-bromo-2-chloro-N-(2-methoxy-5-methylphenyl)benzamide
CID 2529315
N-(4-bromo-2-chlorophenyl)-2-methoxy-5-methylbenzamide
CID 34054741
2-(4-chloro-2-methylanilino)-N-[2-(2-methoxy-5-methylanilino)-2-oxoethyl]acetamide
CID 26507206
2-(5-chloro-2-methoxyanilino)-N-(2,4-dichlorophenyl)acetamide
CID 9099077
2-(5-bromo-2-methoxyanilino)-N-(2-methoxyphenyl)acetamide
CID 87030481
2-(4-bromo-2-methylphenoxy)-N-(2-methoxy-5-methylphenyl)acetamide
CID 1363313
N-(4-bromo-2-methylphenyl)-3-(2-methoxy-5-methylanilino)propanamide
CID 109040066
2-[(2,4-dichlorophenyl)carbamoylamino]-N-(2-methoxy-5-methylphenyl)acetamide
CID 47032016

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromo-2-chloroanilino)-N-(2-methoxy-5-methylphenyl)acetamide?
The IUPAC name of 2-(4-bromo-2-chloroanilino)-N-(2-methoxy-5-methylphenyl)acetamide (CID 33169745) is 2-(4-bromo-2-chloroanilino)-N-(2-methoxy-5-methylphenyl)acetamide.
What is the SMILES notation for 2-(4-bromo-2-chloroanilino)-N-(2-methoxy-5-methylphenyl)acetamide?
The canonical SMILES for 2-(4-bromo-2-chloroanilino)-N-(2-methoxy-5-methylphenyl)acetamide is COc1ccc(C)cc1NC(=O)CNc1ccc(Br)cc1Cl.
What is the InChIKey of 2-(4-bromo-2-chloroanilino)-N-(2-methoxy-5-methylphenyl)acetamide?
The InChIKey is NHLZQDDLYHHBDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16BrClN2O2/c1-10-3-6-15(22-2)14(7-10)20-16(21)9-19-13-5-4-11(17)8-12(13)18/h3-8,19H,9H2,1-2H3,(H,20,21).
What are the key properties of 2-(4-bromo-2-chloroanilino)-N-(2-methoxy-5-methylphenyl)acetamide?
2-(4-bromo-2-chloroanilino)-N-(2-methoxy-5-methylphenyl)acetamide has a molecular weight of 383.67 g/mol, XLogP of 4.47, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromo-2-chloroanilino)-N-(2-methoxy-5-methylphenyl)acetamide is sourced from PubChem (CID 33169745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).