2-bromo-N-naphthalen-2-ylbenzamide

C17H12BrNO — CID 4259663

IUPAC2-bromo-N-naphthalen-2-ylbenzamide
SMILESO=C(Nc1ccc2ccccc2c1)c1ccccc1Br
InChIInChI=1S/C17H12BrNO/c18-16-8-4-3-7-15(16)17(20)19-14-10-9-12-5-1-2-6-13(12)11-14/h1-11H,(H,19,20)
InChIKeyMYKOQRDUYNGOSP-UHFFFAOYSA-N
MW326.19 g/mol
LogP4.85
Rot. Bonds2

About 2-bromo-N-naphthalen-2-ylbenzamide

2-bromo-N-naphthalen-2-ylbenzamide (PubChem CID 4259663) has the molecular formula C17H12BrNO and a molecular weight of 326.19 g/mol. Its IUPAC name is 2-bromo-N-naphthalen-2-ylbenzamide.

Molecular Properties

Compound Name2-bromo-N-naphthalen-2-ylbenzamide
PubChem CID4259663
Molecular FormulaC17H12BrNO
Molecular Weight326.19 g/mol
Exact Mass325.01
IUPAC Name2-bromo-N-naphthalen-2-ylbenzamide
SMILESO=C(Nc1ccc2ccccc2c1)c1ccccc1Br
InChIInChI=1S/C17H12BrNO/c18-16-8-4-3-7-15(16)17(20)19-14-10-9-12-5-1-2-6-13(12)11-14/h1-11H,(H,19,20)
InChIKeyMYKOQRDUYNGOSP-UHFFFAOYSA-N
XLogP4.85
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.19
LogP ≤ 54.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 107027137
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2-bromo-N-(3-methylphenyl)benzamide
CID 532187
2-bromo-N-(3-hydroxy-4-methylphenyl)benzamide
CID 837189
2-bromo-N-(3,5-dimethylphenyl)benzamide
CID 710587
2-bromo-N-(2,3-dihydro-1H-inden-5-yl)benzamide
CID 2673412
2-bromo-N-(4-chloro-3-fluorophenyl)benzamide
CID 47227901
4-[(2-bromobenzoyl)amino]-2-chlorobenzoic acid
CID 28667151
3-amino-4-bromo-N-naphthalen-2-ylbenzamide
CID 61116894
N-naphthalen-2-ylcarbamoyl bromide
CID 115193346
3-bromo-5-chloro-N-naphthalen-2-ylbenzamide
CID 107951653
4-amino-N-naphthalen-2-ylpyridine-3-carboxamide
CID 81240881

Frequently Asked Questions

What is the IUPAC name of 2-bromo-N-naphthalen-2-ylbenzamide?
The IUPAC name of 2-bromo-N-naphthalen-2-ylbenzamide (CID 4259663) is 2-bromo-N-naphthalen-2-ylbenzamide.
What is the SMILES notation for 2-bromo-N-naphthalen-2-ylbenzamide?
The canonical SMILES for 2-bromo-N-naphthalen-2-ylbenzamide is O=C(Nc1ccc2ccccc2c1)c1ccccc1Br.
What is the InChIKey of 2-bromo-N-naphthalen-2-ylbenzamide?
The InChIKey is MYKOQRDUYNGOSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12BrNO/c18-16-8-4-3-7-15(16)17(20)19-14-10-9-12-5-1-2-6-13(12)11-14/h1-11H,(H,19,20).
What are the key properties of 2-bromo-N-naphthalen-2-ylbenzamide?
2-bromo-N-naphthalen-2-ylbenzamide has a molecular weight of 326.19 g/mol, XLogP of 4.85, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-N-naphthalen-2-ylbenzamide is sourced from PubChem (CID 4259663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).