5-bromo-2-(4-bromo-3-methylphenoxy)benzamide

C14H11Br2NO2 — CID 114892345

IUPAC5-bromo-2-(4-bromo-3-methylphenoxy)benzamide
SMILESCc1cc(Oc2ccc(Br)cc2C(N)=O)ccc1Br
InChIInChI=1S/C14H11Br2NO2/c1-8-6-10(3-4-12(8)16)19-13-5-2-9(15)7-11(13)14(17)18/h2-7H,1H3,(H2,17,18)
InChIKeyDIGRTWFXQJJZQU-UHFFFAOYSA-N
MW385.06 g/mol
LogP4.41
Rot. Bonds3

About 5-bromo-2-(4-bromo-3-methylphenoxy)benzamide

5-bromo-2-(4-bromo-3-methylphenoxy)benzamide (PubChem CID 114892345) has the molecular formula C14H11Br2NO2 and a molecular weight of 385.06 g/mol. Its IUPAC name is 5-bromo-2-(4-bromo-3-methylphenoxy)benzamide.

Molecular Properties

Compound Name5-bromo-2-(4-bromo-3-methylphenoxy)benzamide
PubChem CID114892345
Molecular FormulaC14H11Br2NO2
Molecular Weight385.06 g/mol
Exact Mass382.92
IUPAC Name5-bromo-2-(4-bromo-3-methylphenoxy)benzamide
SMILESCc1cc(Oc2ccc(Br)cc2C(N)=O)ccc1Br
InChIInChI=1S/C14H11Br2NO2/c1-8-6-10(3-4-12(8)16)19-13-5-2-9(15)7-11(13)14(17)18/h2-7H,1H3,(H2,17,18)
InChIKeyDIGRTWFXQJJZQU-UHFFFAOYSA-N
XLogP4.41
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.06
LogP ≤ 54.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(2-bromo-4-methylphenoxy)-2-methylbenzamide
CID 81273209
1-[5-bromo-2-(4-chloro-3-methylphenoxy)phenyl]ethanone
CID 82972295
5-bromo-2-propan-2-yloxybenzamide
CID 17052192
5-bromo-2-(4-bromo-3-methylphenoxy)benzonitrile
CID 114891091
1-[5-bromo-2-(4-bromophenoxy)phenyl]ethanone
CID 82966680
5-bromo-2-(3-methyl-4-nitrophenoxy)benzoic acid
CID 114896153
5-bromo-2-(2-hydroxyphenoxy)benzamide
CID 114895131
2-amino-5-(4-bromo-3-methylphenoxy)benzoic acid
CID 83134573
4-(4-bromo-2-chlorophenoxy)-2-methylbenzenecarbothioamide
CID 81278085
1-[2-(4-bromo-3-methylphenoxy)-5-nitrophenyl]ethanone
CID 83136228
2-(4-bromo-3-methylphenoxy)propanamide
CID 81302434
2-(4-bromophenoxy)-4-methylbenzamide
CID 62308096

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-(4-bromo-3-methylphenoxy)benzamide?
The IUPAC name of 5-bromo-2-(4-bromo-3-methylphenoxy)benzamide (CID 114892345) is 5-bromo-2-(4-bromo-3-methylphenoxy)benzamide.
What is the SMILES notation for 5-bromo-2-(4-bromo-3-methylphenoxy)benzamide?
The canonical SMILES for 5-bromo-2-(4-bromo-3-methylphenoxy)benzamide is Cc1cc(Oc2ccc(Br)cc2C(N)=O)ccc1Br.
What is the InChIKey of 5-bromo-2-(4-bromo-3-methylphenoxy)benzamide?
The InChIKey is DIGRTWFXQJJZQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11Br2NO2/c1-8-6-10(3-4-12(8)16)19-13-5-2-9(15)7-11(13)14(17)18/h2-7H,1H3,(H2,17,18).
What are the key properties of 5-bromo-2-(4-bromo-3-methylphenoxy)benzamide?
5-bromo-2-(4-bromo-3-methylphenoxy)benzamide has a molecular weight of 385.06 g/mol, XLogP of 4.41, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-(4-bromo-3-methylphenoxy)benzamide is sourced from PubChem (CID 114892345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).