N-(5-bromo-2-methylphenyl)-2-(2-chlorophenoxy)acetamide

C15H13BrClNO2 — CID 55804154

IUPACN-(5-bromo-2-methylphenyl)-2-(2-chlorophenoxy)acetamide
SMILESCc1ccc(Br)cc1NC(=O)COc1ccccc1Cl
InChIInChI=1S/C15H13BrClNO2/c1-10-6-7-11(16)8-13(10)18-15(19)9-20-14-5-3-2-4-12(14)17/h2-8H,9H2,1H3,(H,18,19)
InChIKeyBLBNLECVDKKGTA-UHFFFAOYSA-N
MW354.63 g/mol
LogP4.43
Rot. Bonds4

About N-(5-bromo-2-methylphenyl)-2-(2-chlorophenoxy)acetamide

N-(5-bromo-2-methylphenyl)-2-(2-chlorophenoxy)acetamide (PubChem CID 55804154) has the molecular formula C15H13BrClNO2 and a molecular weight of 354.63 g/mol. Its IUPAC name is N-(5-bromo-2-methylphenyl)-2-(2-chlorophenoxy)acetamide.

Molecular Properties

Compound NameN-(5-bromo-2-methylphenyl)-2-(2-chlorophenoxy)acetamide
PubChem CID55804154
Molecular FormulaC15H13BrClNO2
Molecular Weight354.63 g/mol
Exact Mass352.98
IUPAC NameN-(5-bromo-2-methylphenyl)-2-(2-chlorophenoxy)acetamide
SMILESCc1ccc(Br)cc1NC(=O)COc1ccccc1Cl
InChIInChI=1S/C15H13BrClNO2/c1-10-6-7-11(16)8-13(10)18-15(19)9-20-14-5-3-2-4-12(14)17/h2-8H,9H2,1H3,(H,18,19)
InChIKeyBLBNLECVDKKGTA-UHFFFAOYSA-N
XLogP4.43
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.63
LogP ≤ 54.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(5-bromo-2-methylphenyl)-2-phenoxyacetamide
CID 43806384
3-[[2-(4-bromo-2-chlorophenoxy)acetyl]amino]-4-methylbenzoic acid
CID 45429183
[2-(5-chloro-2-methylanilino)-2-oxoethyl] 2-(2-chlorophenoxy)acetate
CID 2378568
2-(2-chlorophenoxy)-N-[2-[[2-(2-chlorophenoxy)acetyl]amino]phenyl]acetamide
CID 1032604
N-(5-chloro-2-methylphenyl)-2-(2-hydroxyphenoxy)acetamide
CID 78770477
2-(2-chlorophenoxy)-N-[5-[5-(hydroxymethyl)furan-2-yl]-2-methylphenyl]acetamide
CID 28676829
2-(2-chlorophenoxy)-N-hydroxyacetamide
CID 95562486
2-(4-bromo-2-chlorophenoxy)-N-(2,6-dimethylphenyl)acetamide
CID 2230439
N-(5-amino-2-methylphenyl)-2-(2,3-dichlorophenoxy)acetamide
CID 28537130
4-[2-[2-(4-bromo-2-methylphenoxy)acetyl]hydrazinyl]-N-(2-chlorophenyl)-4-oxobutanamide
CID 5176598
N-(2-acetamidophenyl)-2-(4-bromo-2-methylphenoxy)acetamide
CID 1328492
N-(4-bromo-2-methylphenyl)-2-naphthalen-1-yloxyacetamide
CID 1325558

Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-2-methylphenyl)-2-(2-chlorophenoxy)acetamide?
The IUPAC name of N-(5-bromo-2-methylphenyl)-2-(2-chlorophenoxy)acetamide (CID 55804154) is N-(5-bromo-2-methylphenyl)-2-(2-chlorophenoxy)acetamide.
What is the SMILES notation for N-(5-bromo-2-methylphenyl)-2-(2-chlorophenoxy)acetamide?
The canonical SMILES for N-(5-bromo-2-methylphenyl)-2-(2-chlorophenoxy)acetamide is Cc1ccc(Br)cc1NC(=O)COc1ccccc1Cl.
What is the InChIKey of N-(5-bromo-2-methylphenyl)-2-(2-chlorophenoxy)acetamide?
The InChIKey is BLBNLECVDKKGTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13BrClNO2/c1-10-6-7-11(16)8-13(10)18-15(19)9-20-14-5-3-2-4-12(14)17/h2-8H,9H2,1H3,(H,18,19).
What are the key properties of N-(5-bromo-2-methylphenyl)-2-(2-chlorophenoxy)acetamide?
N-(5-bromo-2-methylphenyl)-2-(2-chlorophenoxy)acetamide has a molecular weight of 354.63 g/mol, XLogP of 4.43, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-2-methylphenyl)-2-(2-chlorophenoxy)acetamide is sourced from PubChem (CID 55804154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).