N-(2,4-dibromophenyl)-2-ethoxybenzamide

C15H13Br2NO2 — CID 3649234

IUPACN-(2,4-dibromophenyl)-2-ethoxybenzamide
SMILESCCOc1ccccc1C(=O)Nc1ccc(Br)cc1Br
InChIInChI=1S/C15H13Br2NO2/c1-2-20-14-6-4-3-5-11(14)15(19)18-13-8-7-10(16)9-12(13)17/h3-9H,2H2,1H3,(H,18,19)
InChIKeySFWATFRICOHHBJ-UHFFFAOYSA-N
MW399.08 g/mol
LogP4.86
Rot. Bonds4

About N-(2,4-dibromophenyl)-2-ethoxybenzamide

N-(2,4-dibromophenyl)-2-ethoxybenzamide (PubChem CID 3649234) has the molecular formula C15H13Br2NO2 and a molecular weight of 399.08 g/mol. Its IUPAC name is N-(2,4-dibromophenyl)-2-ethoxybenzamide.

Molecular Properties

Compound NameN-(2,4-dibromophenyl)-2-ethoxybenzamide
PubChem CID3649234
Molecular FormulaC15H13Br2NO2
Molecular Weight399.08 g/mol
Exact Mass396.93
IUPAC NameN-(2,4-dibromophenyl)-2-ethoxybenzamide
SMILESCCOc1ccccc1C(=O)Nc1ccc(Br)cc1Br
InChIInChI=1S/C15H13Br2NO2/c1-2-20-14-6-4-3-5-11(14)15(19)18-13-8-7-10(16)9-12(13)17/h3-9H,2H2,1H3,(H,18,19)
InChIKeySFWATFRICOHHBJ-UHFFFAOYSA-N
XLogP4.86
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.08
LogP ≤ 54.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-bromo-4-butylphenyl)-2-ethoxybenzamide
CID 53267898
N-(2-bromo-4-methylphenyl)-2-(2-ethoxyethoxy)benzamide
CID 54784480
2-ethoxy-N-[4-[4-[(2-ethoxybenzoyl)amino]-3-methylphenyl]-2-methylphenyl]benzamide
CID 4556792
2,4-dibromo-N-(2-ethoxy-4-methylphenyl)benzamide
CID 103885271
N-(2-bromo-3-pyridinyl)-2-ethoxybenzamide
CID 103819498
2-ethoxy-N-(4-hydroxy-2-methylphenyl)benzamide
CID 1234633
5-bromo-2-ethoxy-N-(2-prop-2-enoxyphenyl)benzamide
CID 17098043
N-(2,5-diethoxyphenyl)-2-ethoxybenzamide
CID 43000684
2-ethoxy-N-[4-[(2-ethoxybenzoyl)amino]phenyl]benzamide
CID 1011206
2-ethoxy-N-(2-fluorophenyl)benzamide
CID 773674
2-ethoxy-N-(2,3,4-trifluorophenyl)benzamide
CID 26358716
3-carboxy-4-[(2-ethoxybenzoyl)amino]phenolate
CID 54689492

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dibromophenyl)-2-ethoxybenzamide?
The IUPAC name of N-(2,4-dibromophenyl)-2-ethoxybenzamide (CID 3649234) is N-(2,4-dibromophenyl)-2-ethoxybenzamide.
What is the SMILES notation for N-(2,4-dibromophenyl)-2-ethoxybenzamide?
The canonical SMILES for N-(2,4-dibromophenyl)-2-ethoxybenzamide is CCOc1ccccc1C(=O)Nc1ccc(Br)cc1Br.
What is the InChIKey of N-(2,4-dibromophenyl)-2-ethoxybenzamide?
The InChIKey is SFWATFRICOHHBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13Br2NO2/c1-2-20-14-6-4-3-5-11(14)15(19)18-13-8-7-10(16)9-12(13)17/h3-9H,2H2,1H3,(H,18,19).
What are the key properties of N-(2,4-dibromophenyl)-2-ethoxybenzamide?
N-(2,4-dibromophenyl)-2-ethoxybenzamide has a molecular weight of 399.08 g/mol, XLogP of 4.86, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dibromophenyl)-2-ethoxybenzamide is sourced from PubChem (CID 3649234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).