N-(2,4-dibromo-6-methylphenyl)formamide

C8H7Br2NO — CID 168652451

IUPACN-(2,4-dibromo-6-methylphenyl)formamide
SMILESCc1cc(Br)cc(Br)c1NC=O
InChIInChI=1S/C8H7Br2NO/c1-5-2-6(9)3-7(10)8(5)11-4-12/h2-4H,1H3,(H,11,12)
InChIKeyRIHCZKSRUBJXIT-UHFFFAOYSA-N
MW292.96 g/mol
LogP3.09
Rot. Bonds2

About N-(2,4-dibromo-6-methylphenyl)formamide

N-(2,4-dibromo-6-methylphenyl)formamide (PubChem CID 168652451) has the molecular formula C8H7Br2NO and a molecular weight of 292.96 g/mol. Its IUPAC name is N-(2,4-dibromo-6-methylphenyl)formamide.

Molecular Properties

Compound NameN-(2,4-dibromo-6-methylphenyl)formamide
PubChem CID168652451
Molecular FormulaC8H7Br2NO
Molecular Weight292.96 g/mol
Exact Mass290.89
IUPAC NameN-(2,4-dibromo-6-methylphenyl)formamide
SMILESCc1cc(Br)cc(Br)c1NC=O
InChIInChI=1S/C8H7Br2NO/c1-5-2-6(9)3-7(10)8(5)11-4-12/h2-4H,1H3,(H,11,12)
InChIKeyRIHCZKSRUBJXIT-UHFFFAOYSA-N
XLogP3.09
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.96
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2,4-dibromo-6-methylbenzaldehyde
CID 102195216
N-[4-(4-formamido-3,5-dimethylphenyl)sulfanyl-2,6-dimethylphenyl]formamide
CID 124926919
1-(2,4-dibromo-6-methylphenyl)-3-phenylurea
CID 4558595
2-cyano-N-(2,4-dibromo-6-methylphenyl)acetamide
CID 168520217
N-(4-bromo-5-methyl-2-pyridinyl)formamide
CID 144727601
4-bromo-3-formamido-6-methyl-2-nitrobenzoic acid
CID 87396056
methyl 4-formamido-3,5-dimethylbenzoate
CID 134546996
N-(2,4-dicyano-6-methylphenyl)formamide
CID 168651715
N-(2-hydroxy-4-methyl-6-oxo-1H-pyridin-3-yl)formamide
CID 19816441
N-[4-(3-hydroxypropyl)-2,6-dimethylphenyl]formamide
CID 168944588
N-(6-bromo-7-methylisoquinolin-3-yl)formamide
CID 163277837
azane;2,4,6-tribromo-N-(2,4,6-tribromophenyl)aniline
CID 88686160

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dibromo-6-methylphenyl)formamide?
The IUPAC name of N-(2,4-dibromo-6-methylphenyl)formamide (CID 168652451) is N-(2,4-dibromo-6-methylphenyl)formamide.
What is the SMILES notation for N-(2,4-dibromo-6-methylphenyl)formamide?
The canonical SMILES for N-(2,4-dibromo-6-methylphenyl)formamide is Cc1cc(Br)cc(Br)c1NC=O.
What is the InChIKey of N-(2,4-dibromo-6-methylphenyl)formamide?
The InChIKey is RIHCZKSRUBJXIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7Br2NO/c1-5-2-6(9)3-7(10)8(5)11-4-12/h2-4H,1H3,(H,11,12).
What are the key properties of N-(2,4-dibromo-6-methylphenyl)formamide?
N-(2,4-dibromo-6-methylphenyl)formamide has a molecular weight of 292.96 g/mol, XLogP of 3.09, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dibromo-6-methylphenyl)formamide is sourced from PubChem (CID 168652451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).