4-bromo-N-(5-chloro-2-methoxyphenyl)-2-fluorobenzamide

C14H10BrClFNO2 — CID 26688337

IUPAC4-bromo-N-(5-chloro-2-methoxyphenyl)-2-fluorobenzamide
SMILESCOc1ccc(Cl)cc1NC(=O)c1ccc(Br)cc1F
InChIInChI=1S/C14H10BrClFNO2/c1-20-13-5-3-9(16)7-12(13)18-14(19)10-4-2-8(15)6-11(10)17/h2-7H,1H3,(H,18,19)
InChIKeyOHLMLAYYYAEKFU-UHFFFAOYSA-N
MW358.59 g/mol
LogP4.50
Rot. Bonds3

About 4-bromo-N-(5-chloro-2-methoxyphenyl)-2-fluorobenzamide

4-bromo-N-(5-chloro-2-methoxyphenyl)-2-fluorobenzamide (PubChem CID 26688337) has the molecular formula C14H10BrClFNO2 and a molecular weight of 358.59 g/mol. Its IUPAC name is 4-bromo-N-(5-chloro-2-methoxyphenyl)-2-fluorobenzamide.

Molecular Properties

Compound Name4-bromo-N-(5-chloro-2-methoxyphenyl)-2-fluorobenzamide
PubChem CID26688337
Molecular FormulaC14H10BrClFNO2
Molecular Weight358.59 g/mol
Exact Mass356.96
IUPAC Name4-bromo-N-(5-chloro-2-methoxyphenyl)-2-fluorobenzamide
SMILESCOc1ccc(Cl)cc1NC(=O)c1ccc(Br)cc1F
InChIInChI=1S/C14H10BrClFNO2/c1-20-13-5-3-9(16)7-12(13)18-14(19)10-4-2-8(15)6-11(10)17/h2-7H,1H3,(H,18,19)
InChIKeyOHLMLAYYYAEKFU-UHFFFAOYSA-N
XLogP4.50
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.59
LogP ≤ 54.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(5-bromo-2-methoxyphenyl)-2,4-difluorobenzamide
CID 47317531
N-(5-chloro-2-methoxyphenyl)-2-fluoro-4-methylbenzamide
CID 79770618
N'-(4-bromo-2-fluorobenzoyl)-5-chloro-2-methoxybenzohydrazide
CID 9085244
2-bromo-N-(5-chloro-2-methoxyphenyl)-4-fluorobenzamide
CID 9191956
2-[(5-bromo-2-methoxybenzoyl)amino]-4-chlorobenzoic acid
CID 1231034
N-(5-bromo-2-methoxyphenyl)-2,5-difluorobenzamide
CID 61074380
4-bromo-N-(4-chloro-2-methylphenyl)-2-fluorobenzamide
CID 24708773
4-chloro-N-(5-chloro-2-methoxyphenyl)-2-hydroxybenzamide
CID 29286691
N-(5-bromo-2-methoxyphenyl)-2-fluoro-5-methylbenzamide
CID 62515870
4-bromo-N-(5-bromo-2-methoxyphenyl)-2-methoxybenzamide
CID 78987917
5-bromo-N-(5-chloro-2-methoxyphenyl)-2-methoxy-3-methylbenzamide
CID 3379612
N-(5-bromo-2-methoxyphenyl)-3-chloro-2-fluorobenzamide
CID 80974125

Frequently Asked Questions

What is the IUPAC name of 4-bromo-N-(5-chloro-2-methoxyphenyl)-2-fluorobenzamide?
The IUPAC name of 4-bromo-N-(5-chloro-2-methoxyphenyl)-2-fluorobenzamide (CID 26688337) is 4-bromo-N-(5-chloro-2-methoxyphenyl)-2-fluorobenzamide.
What is the SMILES notation for 4-bromo-N-(5-chloro-2-methoxyphenyl)-2-fluorobenzamide?
The canonical SMILES for 4-bromo-N-(5-chloro-2-methoxyphenyl)-2-fluorobenzamide is COc1ccc(Cl)cc1NC(=O)c1ccc(Br)cc1F.
What is the InChIKey of 4-bromo-N-(5-chloro-2-methoxyphenyl)-2-fluorobenzamide?
The InChIKey is OHLMLAYYYAEKFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10BrClFNO2/c1-20-13-5-3-9(16)7-12(13)18-14(19)10-4-2-8(15)6-11(10)17/h2-7H,1H3,(H,18,19).
What are the key properties of 4-bromo-N-(5-chloro-2-methoxyphenyl)-2-fluorobenzamide?
4-bromo-N-(5-chloro-2-methoxyphenyl)-2-fluorobenzamide has a molecular weight of 358.59 g/mol, XLogP of 4.50, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-N-(5-chloro-2-methoxyphenyl)-2-fluorobenzamide is sourced from PubChem (CID 26688337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).