2,4-dibromo-N-methylbenzamide

C8H7Br2NO — CID 54214948

IUPAC2,4-dibromo-N-methylbenzamide
SMILESCNC(=O)c1ccc(Br)cc1Br
InChIInChI=1S/C8H7Br2NO/c1-11-8(12)6-3-2-5(9)4-7(6)10/h2-4H,1H3,(H,11,12)
InChIKeyGJXNIUNFWBXZBA-UHFFFAOYSA-N
MW292.96 g/mol
LogP2.57
Rot. Bonds1

About 2,4-dibromo-N-methylbenzamide

2,4-dibromo-N-methylbenzamide (PubChem CID 54214948) has the molecular formula C8H7Br2NO and a molecular weight of 292.96 g/mol. Its IUPAC name is 2,4-dibromo-N-methylbenzamide.

Molecular Properties

Compound Name2,4-dibromo-N-methylbenzamide
PubChem CID54214948
Molecular FormulaC8H7Br2NO
Molecular Weight292.96 g/mol
Exact Mass290.89
IUPAC Name2,4-dibromo-N-methylbenzamide
SMILESCNC(=O)c1ccc(Br)cc1Br
InChIInChI=1S/C8H7Br2NO/c1-11-8(12)6-3-2-5(9)4-7(6)10/h2-4H,1H3,(H,11,12)
InChIKeyGJXNIUNFWBXZBA-UHFFFAOYSA-N
XLogP2.57
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.96
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-bromo-4-iodo-N-methylbenzamide
CID 155462102
2,4-dibromo-N-carbamoylbenzamide
CID 107941660
4-bromo-N-methyl-2-propan-2-ylbenzamide
CID 146035002
5-bromo-N-methyl-2-(methylamino)benzamide
CID 130751837
4-bromo-2-(difluoromethoxy)-N-methylbenzamide
CID 170995658
2,4-dibromo-N-(2-methoxyethyl)benzamide
CID 103882043
(2S)-2-[(2,4-dibromobenzoyl)amino]propanoic acid
CID 107937824
2,4-dibromo-N-(2-bromoethyl)benzamide
CID 107941215
2,4-dibromo-N-(1,3-dihydroxy-2-methylpropan-2-yl)benzamide
CID 104920704
2,4-dibromo-N'-(2-methylbenzoyl)benzohydrazide
CID 19167014
2,4-dibromo-N-(2-hydroxy-2-methylpropyl)benzamide
CID 103883047
2,4-dibromobenzoic acid
CID 11896

Frequently Asked Questions

What is the IUPAC name of 2,4-dibromo-N-methylbenzamide?
The IUPAC name of 2,4-dibromo-N-methylbenzamide (CID 54214948) is 2,4-dibromo-N-methylbenzamide.
What is the SMILES notation for 2,4-dibromo-N-methylbenzamide?
The canonical SMILES for 2,4-dibromo-N-methylbenzamide is CNC(=O)c1ccc(Br)cc1Br.
What is the InChIKey of 2,4-dibromo-N-methylbenzamide?
The InChIKey is GJXNIUNFWBXZBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7Br2NO/c1-11-8(12)6-3-2-5(9)4-7(6)10/h2-4H,1H3,(H,11,12).
What are the key properties of 2,4-dibromo-N-methylbenzamide?
2,4-dibromo-N-methylbenzamide has a molecular weight of 292.96 g/mol, XLogP of 2.57, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dibromo-N-methylbenzamide is sourced from PubChem (CID 54214948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).