2-bromo-6-fluoro-N-naphthalen-1-ylbenzamide

C17H11BrFNO — CID 115678062

IUPAC2-bromo-6-fluoro-N-naphthalen-1-ylbenzamide
SMILESO=C(Nc1cccc2ccccc12)c1c(F)cccc1Br
InChIInChI=1S/C17H11BrFNO/c18-13-8-4-9-14(19)16(13)17(21)20-15-10-3-6-11-5-1-2-7-12(11)15/h1-10H,(H,20,21)
InChIKeyFTMZHCRKEFGNDS-UHFFFAOYSA-N
MW344.18 g/mol
LogP4.99
Rot. Bonds2

About 2-bromo-6-fluoro-N-naphthalen-1-ylbenzamide

2-bromo-6-fluoro-N-naphthalen-1-ylbenzamide (PubChem CID 115678062) has the molecular formula C17H11BrFNO and a molecular weight of 344.18 g/mol. Its IUPAC name is 2-bromo-6-fluoro-N-naphthalen-1-ylbenzamide.

Molecular Properties

Compound Name2-bromo-6-fluoro-N-naphthalen-1-ylbenzamide
PubChem CID115678062
Molecular FormulaC17H11BrFNO
Molecular Weight344.18 g/mol
Exact Mass343.00
IUPAC Name2-bromo-6-fluoro-N-naphthalen-1-ylbenzamide
SMILESO=C(Nc1cccc2ccccc12)c1c(F)cccc1Br
InChIInChI=1S/C17H11BrFNO/c18-13-8-4-9-14(19)16(13)17(21)20-15-10-3-6-11-5-1-2-7-12(11)15/h1-10H,(H,20,21)
InChIKeyFTMZHCRKEFGNDS-UHFFFAOYSA-N
XLogP4.99
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.18
LogP ≤ 54.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2-amino-4-fluorophenyl)-2-bromo-6-fluorobenzamide
CID 114558352
N-(5-amino-2-fluorophenyl)-2-bromo-6-fluorobenzamide
CID 115736640
3-fluoro-N-naphthalen-1-ylpyridine-2-carboxamide
CID 110474866
N-(2-bromophenyl)-2-fluoro-6-methoxybenzamide
CID 65432090
3-[(2-bromo-6-fluorobenzoyl)amino]pyridine-4-carboxylic acid
CID 114558544
2-bromo-6-fluoro-N-(5-fluoro-2-methylphenyl)benzamide
CID 115678106
2-bromo-N-(2,4-dimethylphenyl)-6-fluorobenzamide
CID 113250689
2-(2-fluorophenyl)-N-naphthalen-1-ylacetamide
CID 836511
methyl 3-[(2-bromo-6-fluorobenzoyl)amino]propanoate
CID 115678601
2,4-difluoro-N-naphthalen-1-ylbenzamide
CID 2981920
2-bromo-6-fluoro-N-pyridin-4-ylbenzamide
CID 59618072
2-bromo-6-fluoro-N-(4-methoxyphenyl)benzamide
CID 115678058

Frequently Asked Questions

What is the IUPAC name of 2-bromo-6-fluoro-N-naphthalen-1-ylbenzamide?
The IUPAC name of 2-bromo-6-fluoro-N-naphthalen-1-ylbenzamide (CID 115678062) is 2-bromo-6-fluoro-N-naphthalen-1-ylbenzamide.
What is the SMILES notation for 2-bromo-6-fluoro-N-naphthalen-1-ylbenzamide?
The canonical SMILES for 2-bromo-6-fluoro-N-naphthalen-1-ylbenzamide is O=C(Nc1cccc2ccccc12)c1c(F)cccc1Br.
What is the InChIKey of 2-bromo-6-fluoro-N-naphthalen-1-ylbenzamide?
The InChIKey is FTMZHCRKEFGNDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11BrFNO/c18-13-8-4-9-14(19)16(13)17(21)20-15-10-3-6-11-5-1-2-7-12(11)15/h1-10H,(H,20,21).
What are the key properties of 2-bromo-6-fluoro-N-naphthalen-1-ylbenzamide?
2-bromo-6-fluoro-N-naphthalen-1-ylbenzamide has a molecular weight of 344.18 g/mol, XLogP of 4.99, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-6-fluoro-N-naphthalen-1-ylbenzamide is sourced from PubChem (CID 115678062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).