2-(5-bromo-2-formylphenoxy)benzamide

C14H10BrNO3 — CID 43364679

IUPAC2-(5-bromo-2-formylphenoxy)benzamide
SMILESNC(=O)c1ccccc1Oc1cc(Br)ccc1C=O
InChIInChI=1S/C14H10BrNO3/c15-10-6-5-9(8-17)13(7-10)19-12-4-2-1-3-11(12)14(16)18/h1-8H,(H2,16,18)
InChIKeyJHJQFBAAKHWZJL-UHFFFAOYSA-N
MW320.14 g/mol
LogP3.15
Rot. Bonds4

About 2-(5-bromo-2-formylphenoxy)benzamide

2-(5-bromo-2-formylphenoxy)benzamide (PubChem CID 43364679) has the molecular formula C14H10BrNO3 and a molecular weight of 320.14 g/mol. Its IUPAC name is 2-(5-bromo-2-formylphenoxy)benzamide.

Molecular Properties

Compound Name2-(5-bromo-2-formylphenoxy)benzamide
PubChem CID43364679
Molecular FormulaC14H10BrNO3
Molecular Weight320.14 g/mol
Exact Mass318.98
IUPAC Name2-(5-bromo-2-formylphenoxy)benzamide
SMILESNC(=O)c1ccccc1Oc1cc(Br)ccc1C=O
InChIInChI=1S/C14H10BrNO3/c15-10-6-5-9(8-17)13(7-10)19-12-4-2-1-3-11(12)14(16)18/h1-8H,(H2,16,18)
InChIKeyJHJQFBAAKHWZJL-UHFFFAOYSA-N
XLogP3.15
TPSA69.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.14
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

2-(4-bromo-2-propan-2-ylphenoxy)benzamide
CID 115402255
5-bromo-2-(2-hydroxyphenoxy)benzamide
CID 114895131
4-bromo-2-(4-bromo-2-chlorophenoxy)benzaldehyde
CID 43364723
4-bromo-2-(4-fluorophenoxy)benzaldehyde
CID 43173970
2-(3-chloro-2-formylphenoxy)benzamide
CID 28603903
(2-carbamoylphenyl) hydrogen carbonate
CID 91199327
(5-bromo-2-formylphenyl) hypochlorite
CID 22608477
4-bromo-2-(2,6-dimethylphenoxy)benzaldehyde
CID 43364688
2-(3-bromo-5-fluorophenoxy)benzamide
CID 81331712
2-(5-bromo-2-chlorophenoxy)-4-chlorobenzaldehyde
CID 114844928
4-bromo-2-(2,4-dimethylphenoxy)benzaldehyde
CID 43364692
4-bromo-2-(2,5-dimethylphenoxy)benzaldehyde
CID 43364705

Frequently Asked Questions

What is the IUPAC name of 2-(5-bromo-2-formylphenoxy)benzamide?
The IUPAC name of 2-(5-bromo-2-formylphenoxy)benzamide (CID 43364679) is 2-(5-bromo-2-formylphenoxy)benzamide.
What is the SMILES notation for 2-(5-bromo-2-formylphenoxy)benzamide?
The canonical SMILES for 2-(5-bromo-2-formylphenoxy)benzamide is NC(=O)c1ccccc1Oc1cc(Br)ccc1C=O.
What is the InChIKey of 2-(5-bromo-2-formylphenoxy)benzamide?
The InChIKey is JHJQFBAAKHWZJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10BrNO3/c15-10-6-5-9(8-17)13(7-10)19-12-4-2-1-3-11(12)14(16)18/h1-8H,(H2,16,18).
What are the key properties of 2-(5-bromo-2-formylphenoxy)benzamide?
2-(5-bromo-2-formylphenoxy)benzamide has a molecular weight of 320.14 g/mol, XLogP of 3.15, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-bromo-2-formylphenoxy)benzamide is sourced from PubChem (CID 43364679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).