2-(2-bromophenoxy)-N-[(Z)-(2-chlorophenyl)methylideneamino]acetamide

C15H12BrClN2O2 — CID 6083444

IUPAC2-(2-bromophenoxy)-N-[(Z)-(2-chlorophenyl)methylideneamino]acetamide
SMILESO=C(COc1ccccc1Br)N/N=C\c1ccccc1Cl
InChIInChI=1S/C15H12BrClN2O2/c16-12-6-2-4-8-14(12)21-10-15(20)19-18-9-11-5-1-3-7-13(11)17/h1-9H,10H2,(H,19,20)/b18-9-
InChIKeyRYOJKVJYCOZGNF-NVMNQCDNSA-N
MW367.63 g/mol
LogP3.63
Rot. Bonds5

About 2-(2-bromophenoxy)-N-[(Z)-(2-chlorophenyl)methylideneamino]acetamide

2-(2-bromophenoxy)-N-[(Z)-(2-chlorophenyl)methylideneamino]acetamide (PubChem CID 6083444) has the molecular formula C15H12BrClN2O2 and a molecular weight of 367.63 g/mol. Its IUPAC name is 2-(2-bromophenoxy)-N-[(Z)-(2-chlorophenyl)methylideneamino]acetamide.

Molecular Properties

Compound Name2-(2-bromophenoxy)-N-[(Z)-(2-chlorophenyl)methylideneamino]acetamide
PubChem CID6083444
Molecular FormulaC15H12BrClN2O2
Molecular Weight367.63 g/mol
Exact Mass365.98
IUPAC Name2-(2-bromophenoxy)-N-[(Z)-(2-chlorophenyl)methylideneamino]acetamide
SMILESO=C(COc1ccccc1Br)N/N=C\c1ccccc1Cl
InChIInChI=1S/C15H12BrClN2O2/c16-12-6-2-4-8-14(12)21-10-15(20)19-18-9-11-5-1-3-7-13(11)17/h1-9H,10H2,(H,19,20)/b18-9-
InChIKeyRYOJKVJYCOZGNF-NVMNQCDNSA-N
XLogP3.63
TPSA50.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.63
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-(2-bromophenoxy)-N-[(E)-(2-hydroxyphenyl)methylideneamino]acetamide
CID 135541771
2-(2-bromo-4-tert-butylphenoxy)-N-[(2-chlorophenyl)methylideneamino]acetamide
CID 4922179
N-[(2-bromophenyl)methylideneamino]-2-(2-fluorophenoxy)acetamide
CID 2695035
2-[2-[[[2-(2-chlorophenoxy)acetyl]hydrazinylidene]methyl]phenoxy]acetic acid
CID 1104421
2-(2,3-dichlorophenoxy)-N-[(E)-(2,3-dichlorophenyl)methylideneamino]acetamide
CID 45055184
2-(2,3-dichlorophenoxy)-N-[(Z)-(2-hydroxyphenyl)methylideneamino]acetamide
CID 136808275
2-(2-chlorophenoxy)-N-[(2-nitrophenyl)methylideneamino]acetamide
CID 958366
2-(2-bromophenoxy)-N-[(E)-(4-hydroxyphenyl)methylideneamino]acetamide
CID 135610844
2-(2-bromophenoxy)-N-[(E)-[4-[(2-chlorophenyl)methoxy]phenyl]methylideneamino]acetamide
CID 19189856
N-[(2-bromophenyl)methylideneamino]-2-(4-chlorophenoxy)acetamide
CID 2311965
N-[(Z)-(2-chlorophenyl)methylideneamino]-2-(4-iodophenoxy)acetamide
CID 6287016
2-(2,3-dichlorophenoxy)-N-(naphthalen-1-ylmethylideneamino)acetamide
CID 4059063

Frequently Asked Questions

What is the IUPAC name of 2-(2-bromophenoxy)-N-[(Z)-(2-chlorophenyl)methylideneamino]acetamide?
The IUPAC name of 2-(2-bromophenoxy)-N-[(Z)-(2-chlorophenyl)methylideneamino]acetamide (CID 6083444) is 2-(2-bromophenoxy)-N-[(Z)-(2-chlorophenyl)methylideneamino]acetamide.
What is the SMILES notation for 2-(2-bromophenoxy)-N-[(Z)-(2-chlorophenyl)methylideneamino]acetamide?
The canonical SMILES for 2-(2-bromophenoxy)-N-[(Z)-(2-chlorophenyl)methylideneamino]acetamide is O=C(COc1ccccc1Br)N/N=C\c1ccccc1Cl.
What is the InChIKey of 2-(2-bromophenoxy)-N-[(Z)-(2-chlorophenyl)methylideneamino]acetamide?
The InChIKey is RYOJKVJYCOZGNF-NVMNQCDNSA-N. The full InChI is InChI=1S/C15H12BrClN2O2/c16-12-6-2-4-8-14(12)21-10-15(20)19-18-9-11-5-1-3-7-13(11)17/h1-9H,10H2,(H,19,20)/b18-9-.
What are the key properties of 2-(2-bromophenoxy)-N-[(Z)-(2-chlorophenyl)methylideneamino]acetamide?
2-(2-bromophenoxy)-N-[(Z)-(2-chlorophenyl)methylideneamino]acetamide has a molecular weight of 367.63 g/mol, XLogP of 3.63, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromophenoxy)-N-[(Z)-(2-chlorophenyl)methylideneamino]acetamide is sourced from PubChem (CID 6083444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).