N-[2-[(4-bromo-2-chlorophenyl)methoxy]phenyl]acetamide

C15H13BrClNO2 — CID 48923418

IUPACN-[2-[(4-bromo-2-chlorophenyl)methoxy]phenyl]acetamide
SMILESCC(=O)Nc1ccccc1OCc1ccc(Br)cc1Cl
InChIInChI=1S/C15H13BrClNO2/c1-10(19)18-14-4-2-3-5-15(14)20-9-11-6-7-12(16)8-13(11)17/h2-8H,9H2,1H3,(H,18,19)
InChIKeyHSWVECJEHSVZNQ-UHFFFAOYSA-N
MW354.63 g/mol
LogP4.64
Rot. Bonds4

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

N-[2-[(4-bromo-2-chlorophenyl)methoxy]phenyl]acetamide (PubChem CID 48923418) has the molecular formula C15H13BrClNO2 and a molecular weight of 354.63 g/mol. Its IUPAC name is N-[2-[(4-bromo-2-chlorophenyl)methoxy]phenyl]acetamide.

Molecular Properties

Compound NameN-[2-[(4-bromo-2-chlorophenyl)methoxy]phenyl]acetamide
PubChem CID48923418
Molecular FormulaC15H13BrClNO2
Molecular Weight354.63 g/mol
Exact Mass352.98
IUPAC NameN-[2-[(4-bromo-2-chlorophenyl)methoxy]phenyl]acetamide
SMILESCC(=O)Nc1ccccc1OCc1ccc(Br)cc1Cl
InChIInChI=1S/C15H13BrClNO2/c1-10(19)18-14-4-2-3-5-15(14)20-9-11-6-7-12(16)8-13(11)17/h2-8H,9H2,1H3,(H,18,19)
InChIKeyHSWVECJEHSVZNQ-UHFFFAOYSA-N
XLogP4.64
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 ≤ 54.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-[(5-fluoro-2-methoxyphenyl)methoxy]phenyl]acetamide
CID 9017920
N-[2-[(2-amino-6-chlorophenyl)methoxy]phenyl]acetamide
CID 63745431
N-[2-[4-(aminomethyl)-3-chlorophenoxy]phenyl]acetamide
CID 62946547
N-[2-[2-(3-bromophenyl)-2-oxoethoxy]phenyl]acetamide
CID 43413534
3-[(4-bromo-2-chlorophenyl)methoxy]-2-chloropyridine
CID 115634536
N-[2-[(3-amino-4-bromophenyl)methoxy]phenyl]acetamide
CID 115557455
N-[2-[4-(2-acetamidophenoxy)butoxy]phenyl]acetamide
CID 3708150
N'-[[5-bromo-2-[(2-chlorophenyl)methoxy]phenyl]methylideneamino]-N-(2-methoxyphenyl)propanediamide
CID 4679540
methyl (E)-3-[5-bromo-2-[(2-chlorophenyl)methoxy]phenyl]prop-2-enoate
CID 102535216
N-[2-[10-(2-acetamidophenoxy)decoxy]phenyl]acetamide
CID 4569719
(1S)-1-[5-bromo-2-[(4-bromo-2-chlorophenyl)methoxy]phenyl]ethanol
CID 104862353
(1R)-1-[4-bromo-2-[(4-bromo-2-chlorophenyl)methoxy]phenyl]ethanol
CID 102948801

Frequently Asked Questions

What is the IUPAC name of N-[2-[(4-bromo-2-chlorophenyl)methoxy]phenyl]acetamide?
The IUPAC name of N-[2-[(4-bromo-2-chlorophenyl)methoxy]phenyl]acetamide (CID 48923418) is N-[2-[(4-bromo-2-chlorophenyl)methoxy]phenyl]acetamide.
What is the SMILES notation for N-[2-[(4-bromo-2-chlorophenyl)methoxy]phenyl]acetamide?
The canonical SMILES for N-[2-[(4-bromo-2-chlorophenyl)methoxy]phenyl]acetamide is CC(=O)Nc1ccccc1OCc1ccc(Br)cc1Cl.
What is the InChIKey of N-[2-[(4-bromo-2-chlorophenyl)methoxy]phenyl]acetamide?
The InChIKey is HSWVECJEHSVZNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13BrClNO2/c1-10(19)18-14-4-2-3-5-15(14)20-9-11-6-7-12(16)8-13(11)17/h2-8H,9H2,1H3,(H,18,19).
What are the key properties of N-[2-[(4-bromo-2-chlorophenyl)methoxy]phenyl]acetamide?
N-[2-[(4-bromo-2-chlorophenyl)methoxy]phenyl]acetamide has a molecular weight of 354.63 g/mol, XLogP of 4.64, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(4-bromo-2-chlorophenyl)methoxy]phenyl]acetamide is sourced from PubChem (CID 48923418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).