2-bromo-5-fluoro-N-quinolin-2-ylbenzamide

C16H10BrFN2O — CID 51265955

IUPAC2-bromo-5-fluoro-N-quinolin-2-ylbenzamide
SMILESO=C(Nc1ccc2ccccc2n1)c1cc(F)ccc1Br
InChIInChI=1S/C16H10BrFN2O/c17-13-7-6-11(18)9-12(13)16(21)20-15-8-5-10-3-1-2-4-14(10)19-15/h1-9H,(H,19,20,21)
InChIKeyQJHCEVDDBIVIGE-UHFFFAOYSA-N
MW345.17 g/mol
LogP4.39
Rot. Bonds2

About 2-bromo-5-fluoro-N-quinolin-2-ylbenzamide

2-bromo-5-fluoro-N-quinolin-2-ylbenzamide (PubChem CID 51265955) has the molecular formula C16H10BrFN2O and a molecular weight of 345.17 g/mol. Its IUPAC name is 2-bromo-5-fluoro-N-quinolin-2-ylbenzamide.

Molecular Properties

Compound Name2-bromo-5-fluoro-N-quinolin-2-ylbenzamide
PubChem CID51265955
Molecular FormulaC16H10BrFN2O
Molecular Weight345.17 g/mol
Exact Mass344.00
IUPAC Name2-bromo-5-fluoro-N-quinolin-2-ylbenzamide
SMILESO=C(Nc1ccc2ccccc2n1)c1cc(F)ccc1Br
InChIInChI=1S/C16H10BrFN2O/c17-13-7-6-11(18)9-12(13)16(21)20-15-8-5-10-3-1-2-4-14(10)19-15/h1-9H,(H,19,20,21)
InChIKeyQJHCEVDDBIVIGE-UHFFFAOYSA-N
XLogP4.39
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.17
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-bromo-N-(6-bromo-2-pyridinyl)-5-fluorobenzamide
CID 43520358
3,5-difluoro-N-quinolin-2-ylbenzamide
CID 51193516
N-quinolin-2-ylnaphthalene-2-carboxamide
CID 46811579
2-[(2-bromo-5-fluorobenzoyl)amino]benzoic acid
CID 16773060
N-(6-bromo-2-pyridinyl)-5-fluoro-2-methylbenzamide
CID 55134915
2-bromo-5-fluoro-N-pyridin-4-ylbenzamide
CID 24689645
N-(6-bromo-2-pyridinyl)-2,5-difluorobenzamide
CID 43520386
N-[(2-bromo-5-fluorophenyl)methyl]quinoline-2-carboxamide
CID 60535331
2-bromo-N-(2,6-dichlorophenyl)-5-fluorobenzamide
CID 60667247
2,3,4-trihydroxy-N-quinolin-2-ylbenzamide
CID 54185364
2-bromo-5-fluoro-N-pyridin-3-ylbenzamide
CID 24699857
N-(1,3-benzothiazol-2-ylmethyl)-2-bromo-5-fluorobenzamide
CID 18110803

Frequently Asked Questions

What is the IUPAC name of 2-bromo-5-fluoro-N-quinolin-2-ylbenzamide?
The IUPAC name of 2-bromo-5-fluoro-N-quinolin-2-ylbenzamide (CID 51265955) is 2-bromo-5-fluoro-N-quinolin-2-ylbenzamide.
What is the SMILES notation for 2-bromo-5-fluoro-N-quinolin-2-ylbenzamide?
The canonical SMILES for 2-bromo-5-fluoro-N-quinolin-2-ylbenzamide is O=C(Nc1ccc2ccccc2n1)c1cc(F)ccc1Br.
What is the InChIKey of 2-bromo-5-fluoro-N-quinolin-2-ylbenzamide?
The InChIKey is QJHCEVDDBIVIGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10BrFN2O/c17-13-7-6-11(18)9-12(13)16(21)20-15-8-5-10-3-1-2-4-14(10)19-15/h1-9H,(H,19,20,21).
What are the key properties of 2-bromo-5-fluoro-N-quinolin-2-ylbenzamide?
2-bromo-5-fluoro-N-quinolin-2-ylbenzamide has a molecular weight of 345.17 g/mol, XLogP of 4.39, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-5-fluoro-N-quinolin-2-ylbenzamide is sourced from PubChem (CID 51265955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).