N-(2-bromophenyl)-2-fluoro-6-methoxybenzamide

C14H11BrFNO2 — CID 65432090

IUPACN-(2-bromophenyl)-2-fluoro-6-methoxybenzamide
SMILESCOc1cccc(F)c1C(=O)Nc1ccccc1Br
InChIInChI=1S/C14H11BrFNO2/c1-19-12-8-4-6-10(16)13(12)14(18)17-11-7-3-2-5-9(11)15/h2-8H,1H3,(H,17,18)
InChIKeyIQSMTGAOYMYHIW-UHFFFAOYSA-N
MW324.15 g/mol
LogP3.85
Rot. Bonds3

About N-(2-bromophenyl)-2-fluoro-6-methoxybenzamide

N-(2-bromophenyl)-2-fluoro-6-methoxybenzamide (PubChem CID 65432090) has the molecular formula C14H11BrFNO2 and a molecular weight of 324.15 g/mol. Its IUPAC name is N-(2-bromophenyl)-2-fluoro-6-methoxybenzamide.

Molecular Properties

Compound NameN-(2-bromophenyl)-2-fluoro-6-methoxybenzamide
PubChem CID65432090
Molecular FormulaC14H11BrFNO2
Molecular Weight324.15 g/mol
Exact Mass323.00
IUPAC NameN-(2-bromophenyl)-2-fluoro-6-methoxybenzamide
SMILESCOc1cccc(F)c1C(=O)Nc1ccccc1Br
InChIInChI=1S/C14H11BrFNO2/c1-19-12-8-4-6-10(16)13(12)14(18)17-11-7-3-2-5-9(11)15/h2-8H,1H3,(H,17,18)
InChIKeyIQSMTGAOYMYHIW-UHFFFAOYSA-N
XLogP3.85
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.15
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-bromophenyl)-2-fluoro-6-methoxybenzamide?
The IUPAC name of N-(2-bromophenyl)-2-fluoro-6-methoxybenzamide (CID 65432090) is N-(2-bromophenyl)-2-fluoro-6-methoxybenzamide.
What is the SMILES notation for N-(2-bromophenyl)-2-fluoro-6-methoxybenzamide?
The canonical SMILES for N-(2-bromophenyl)-2-fluoro-6-methoxybenzamide is COc1cccc(F)c1C(=O)Nc1ccccc1Br.
What is the InChIKey of N-(2-bromophenyl)-2-fluoro-6-methoxybenzamide?
The InChIKey is IQSMTGAOYMYHIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11BrFNO2/c1-19-12-8-4-6-10(16)13(12)14(18)17-11-7-3-2-5-9(11)15/h2-8H,1H3,(H,17,18).
What are the key properties of N-(2-bromophenyl)-2-fluoro-6-methoxybenzamide?
N-(2-bromophenyl)-2-fluoro-6-methoxybenzamide has a molecular weight of 324.15 g/mol, XLogP of 3.85, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromophenyl)-2-fluoro-6-methoxybenzamide is sourced from PubChem (CID 65432090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).