N-[4-(4-bromophenoxy)phenyl]-2-(4-chlorophenyl)acetamide

C20H15BrClNO2 — CID 4575386

IUPACN-[4-(4-bromophenoxy)phenyl]-2-(4-chlorophenyl)acetamide
SMILESO=C(Cc1ccc(Cl)cc1)Nc1ccc(Oc2ccc(Br)cc2)cc1
InChIInChI=1S/C20H15BrClNO2/c21-15-3-9-18(10-4-15)25-19-11-7-17(8-12-19)23-20(24)13-14-1-5-16(22)6-2-14/h1-12H,13H2,(H,23,24)
InChIKeyRXMWRRSVDIOTON-UHFFFAOYSA-N
MW416.70 g/mol
LogP6.08
Rot. Bonds5

About N-[4-(4-bromophenoxy)phenyl]-2-(4-chlorophenyl)acetamide

N-[4-(4-bromophenoxy)phenyl]-2-(4-chlorophenyl)acetamide (PubChem CID 4575386) has the molecular formula C20H15BrClNO2 and a molecular weight of 416.70 g/mol. Its IUPAC name is N-[4-(4-bromophenoxy)phenyl]-2-(4-chlorophenyl)acetamide.

Molecular Properties

Compound NameN-[4-(4-bromophenoxy)phenyl]-2-(4-chlorophenyl)acetamide
PubChem CID4575386
Molecular FormulaC20H15BrClNO2
Molecular Weight416.70 g/mol
Exact Mass415.00
IUPAC NameN-[4-(4-bromophenoxy)phenyl]-2-(4-chlorophenyl)acetamide
SMILESO=C(Cc1ccc(Cl)cc1)Nc1ccc(Oc2ccc(Br)cc2)cc1
InChIInChI=1S/C20H15BrClNO2/c21-15-3-9-18(10-4-15)25-19-11-7-17(8-12-19)23-20(24)13-14-1-5-16(22)6-2-14/h1-12H,13H2,(H,23,24)
InChIKeyRXMWRRSVDIOTON-UHFFFAOYSA-N
XLogP6.08
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500416.70
LogP ≤ 56.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-chlorophenyl)-N-[4-(3-methylphenoxy)phenyl]acetamide
CID 5085866
2-chloro-N-[4-(4-chlorophenoxy)phenyl]acetamide
CID 2782070
2-(4-bromophenyl)-N-(4-ethoxyphenyl)acetamide
CID 2268503
N-(4-bromophenyl)-2-(4-ethoxyphenyl)acetamide
CID 8719858
N-[4-(4-bromophenoxy)phenyl]-2-(2-fluorophenyl)acetamide
CID 7964936
2-(4-chlorophenyl)-N-[4-(trifluoromethoxy)phenyl]acetamide
CID 2678277
N-(4-chlorophenyl)-2-(4-fluorophenyl)acetamide
CID 7027780
2-(4-bromophenyl)-N-(4-phenylmethoxyphenyl)acetamide
CID 1343788
N-(4-bromophenyl)-2-(3,4-dichlorophenyl)acetamide
CID 2598783
N-[4-[[2-(4-bromophenoxy)acetyl]amino]phenyl]-2-phenylacetamide
CID 1256496
2-(4-chlorophenyl)-N-[4-(3-phenylpropoxy)phenyl]acetamide
CID 17130169
1-[(4-bromophenyl)methyl]-3-(4-chlorophenyl)urea
CID 60968991

Frequently Asked Questions

What is the IUPAC name of N-[4-(4-bromophenoxy)phenyl]-2-(4-chlorophenyl)acetamide?
The IUPAC name of N-[4-(4-bromophenoxy)phenyl]-2-(4-chlorophenyl)acetamide (CID 4575386) is N-[4-(4-bromophenoxy)phenyl]-2-(4-chlorophenyl)acetamide.
What is the SMILES notation for N-[4-(4-bromophenoxy)phenyl]-2-(4-chlorophenyl)acetamide?
The canonical SMILES for N-[4-(4-bromophenoxy)phenyl]-2-(4-chlorophenyl)acetamide is O=C(Cc1ccc(Cl)cc1)Nc1ccc(Oc2ccc(Br)cc2)cc1.
What is the InChIKey of N-[4-(4-bromophenoxy)phenyl]-2-(4-chlorophenyl)acetamide?
The InChIKey is RXMWRRSVDIOTON-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15BrClNO2/c21-15-3-9-18(10-4-15)25-19-11-7-17(8-12-19)23-20(24)13-14-1-5-16(22)6-2-14/h1-12H,13H2,(H,23,24).
What are the key properties of N-[4-(4-bromophenoxy)phenyl]-2-(4-chlorophenyl)acetamide?
N-[4-(4-bromophenoxy)phenyl]-2-(4-chlorophenyl)acetamide has a molecular weight of 416.70 g/mol, XLogP of 6.08, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4-bromophenoxy)phenyl]-2-(4-chlorophenyl)acetamide is sourced from PubChem (CID 4575386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).