2,5-dibromo-N-[2-(ethylamino)-2-oxoethyl]benzamide

C11H12Br2N2O2 — CID 114370284

IUPAC2,5-dibromo-N-[2-(ethylamino)-2-oxoethyl]benzamide
SMILESCCNC(=O)CNC(=O)c1cc(Br)ccc1Br
InChIInChI=1S/C11H12Br2N2O2/c1-2-14-10(16)6-15-11(17)8-5-7(12)3-4-9(8)13/h3-5H,2,6H2,1H3,(H,14,16)(H,15,17)
InChIKeyPJCQCKCNUJGNRS-UHFFFAOYSA-N
MW364.04 g/mol
LogP2.08
Rot. Bonds4

About 2,5-dibromo-N-[2-(ethylamino)-2-oxoethyl]benzamide

2,5-dibromo-N-[2-(ethylamino)-2-oxoethyl]benzamide (PubChem CID 114370284) has the molecular formula C11H12Br2N2O2 and a molecular weight of 364.04 g/mol. Its IUPAC name is 2,5-dibromo-N-[2-(ethylamino)-2-oxoethyl]benzamide.

Molecular Properties

Compound Name2,5-dibromo-N-[2-(ethylamino)-2-oxoethyl]benzamide
PubChem CID114370284
Molecular FormulaC11H12Br2N2O2
Molecular Weight364.04 g/mol
Exact Mass361.93
IUPAC Name2,5-dibromo-N-[2-(ethylamino)-2-oxoethyl]benzamide
SMILESCCNC(=O)CNC(=O)c1cc(Br)ccc1Br
InChIInChI=1S/C11H12Br2N2O2/c1-2-14-10(16)6-15-11(17)8-5-7(12)3-4-9(8)13/h3-5H,2,6H2,1H3,(H,14,16)(H,15,17)
InChIKeyPJCQCKCNUJGNRS-UHFFFAOYSA-N
XLogP2.08
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.04
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2,5-dibromo-N-[2-(ethylamino)ethyl]benzamide
CID 114374303
2,5-dibromo-N-(2-chloroprop-2-enyl)benzamide
CID 114372871
4-bromo-1-N,2-N-diethylbenzene-1,2-dicarboxamide
CID 119013862
5-bromo-2-methyl-N-[2-oxo-2-(propylamino)ethyl]benzamide
CID 65306800
3,5-dibromo-N-[2-(ethylamino)-2-oxoethyl]benzamide
CID 103907474
2,5-dibromo-N-(2-chlorobutyl)benzamide
CID 114375877
5-bromo-N-ethyl-2-iodobenzamide
CID 47100033
2-bromo-5-chloro-N-ethylbenzamide
CID 18630175
5-bromo-2-methyl-N-[2-(methylamino)-2-oxoethyl]benzamide
CID 65306886
N-(3-aminopropyl)-2,5-dibromobenzamide
CID 114368344
2,5-dibromo-N-[3-oxo-3-(propan-2-ylamino)propyl]benzamide
CID 114372816
2-bromo-N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-5-methoxybenzamide
CID 27781318

Frequently Asked Questions

What is the IUPAC name of 2,5-dibromo-N-[2-(ethylamino)-2-oxoethyl]benzamide?
The IUPAC name of 2,5-dibromo-N-[2-(ethylamino)-2-oxoethyl]benzamide (CID 114370284) is 2,5-dibromo-N-[2-(ethylamino)-2-oxoethyl]benzamide.
What is the SMILES notation for 2,5-dibromo-N-[2-(ethylamino)-2-oxoethyl]benzamide?
The canonical SMILES for 2,5-dibromo-N-[2-(ethylamino)-2-oxoethyl]benzamide is CCNC(=O)CNC(=O)c1cc(Br)ccc1Br.
What is the InChIKey of 2,5-dibromo-N-[2-(ethylamino)-2-oxoethyl]benzamide?
The InChIKey is PJCQCKCNUJGNRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12Br2N2O2/c1-2-14-10(16)6-15-11(17)8-5-7(12)3-4-9(8)13/h3-5H,2,6H2,1H3,(H,14,16)(H,15,17).
What are the key properties of 2,5-dibromo-N-[2-(ethylamino)-2-oxoethyl]benzamide?
2,5-dibromo-N-[2-(ethylamino)-2-oxoethyl]benzamide has a molecular weight of 364.04 g/mol, XLogP of 2.08, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dibromo-N-[2-(ethylamino)-2-oxoethyl]benzamide is sourced from PubChem (CID 114370284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).