3,5-dibromo-2-methoxy-N,N-dimethylbenzamide

C10H11Br2NO2 — CID 50850191

IUPAC3,5-dibromo-2-methoxy-N,N-dimethylbenzamide
SMILESCOc1c(Br)cc(Br)cc1C(=O)N(C)C
InChIInChI=1S/C10H11Br2NO2/c1-13(2)10(14)7-4-6(11)5-8(12)9(7)15-3/h4-5H,1-3H3
InChIKeyRUCWDOVCQJWJMA-UHFFFAOYSA-N
MW337.01 g/mol
LogP2.92
Rot. Bonds2

About 3,5-dibromo-2-methoxy-N,N-dimethylbenzamide

3,5-dibromo-2-methoxy-N,N-dimethylbenzamide (PubChem CID 50850191) has the molecular formula C10H11Br2NO2 and a molecular weight of 337.01 g/mol. Its IUPAC name is 3,5-dibromo-2-methoxy-N,N-dimethylbenzamide.

Molecular Properties

Compound Name3,5-dibromo-2-methoxy-N,N-dimethylbenzamide
PubChem CID50850191
Molecular FormulaC10H11Br2NO2
Molecular Weight337.01 g/mol
Exact Mass334.92
IUPAC Name3,5-dibromo-2-methoxy-N,N-dimethylbenzamide
SMILESCOc1c(Br)cc(Br)cc1C(=O)N(C)C
InChIInChI=1S/C10H11Br2NO2/c1-13(2)10(14)7-4-6(11)5-8(12)9(7)15-3/h4-5H,1-3H3
InChIKeyRUCWDOVCQJWJMA-UHFFFAOYSA-N
XLogP2.92
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.01
LogP ≤ 52.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3,5-dibromo-2-methoxybenzoic acid
CID 643392
3,5-dibromo-2-methoxybenzamide
CID 28665425
3,5-dibromo-N-[4-[(3,5-dibromo-2-methoxybenzoyl)amino]phenyl]-2-methoxybenzamide
CID 5142163
4-(3,5-dibromo-2-methoxyphenyl)-4-oxobutanal
CID 14431137
3-bromo-N-(2-hydroxy-2-methylpropyl)-2,5-dimethoxy-N-methylbenzamide
CID 79380613
3,5-dibromo-N-(4-bromo-2-iodophenyl)-2-methoxybenzamide
CID 3452845
3,5-dibromo-2-methoxy-N-(2-methoxyphenyl)benzamide
CID 3948715
3,5-dibromo-N-(2-chlorophenyl)-2-methoxybenzamide
CID 22777208
3-bromo-N-[2-(diethylamino)-2-oxoethyl]-2,5-dimethoxy-N-methylbenzamide
CID 39948024
N-(2-aminophenyl)-3,5-dibromo-2-methoxybenzamide
CID 91687679
3,5-dibromo-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methoxybenzamide
CID 17111500
5-bromo-2-fluoro-N,N-dimethyl-3-sulfamoylbenzamide
CID 65373691

Frequently Asked Questions

What is the IUPAC name of 3,5-dibromo-2-methoxy-N,N-dimethylbenzamide?
The IUPAC name of 3,5-dibromo-2-methoxy-N,N-dimethylbenzamide (CID 50850191) is 3,5-dibromo-2-methoxy-N,N-dimethylbenzamide.
What is the SMILES notation for 3,5-dibromo-2-methoxy-N,N-dimethylbenzamide?
The canonical SMILES for 3,5-dibromo-2-methoxy-N,N-dimethylbenzamide is COc1c(Br)cc(Br)cc1C(=O)N(C)C.
What is the InChIKey of 3,5-dibromo-2-methoxy-N,N-dimethylbenzamide?
The InChIKey is RUCWDOVCQJWJMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11Br2NO2/c1-13(2)10(14)7-4-6(11)5-8(12)9(7)15-3/h4-5H,1-3H3.
What are the key properties of 3,5-dibromo-2-methoxy-N,N-dimethylbenzamide?
3,5-dibromo-2-methoxy-N,N-dimethylbenzamide has a molecular weight of 337.01 g/mol, XLogP of 2.92, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dibromo-2-methoxy-N,N-dimethylbenzamide is sourced from PubChem (CID 50850191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).