N-(5-bromo-2-pyridinyl)-4-(3-fluoro-2-pyridinyl)benzamide

C17H11BrFN3O — CID 59673732

IUPACN-(5-bromo-2-pyridinyl)-4-(3-fluoro-2-pyridinyl)benzamide
SMILESO=C(Nc1ccc(Br)cn1)c1ccc(-c2ncccc2F)cc1
InChIInChI=1S/C17H11BrFN3O/c18-13-7-8-15(21-10-13)22-17(23)12-5-3-11(4-6-12)16-14(19)2-1-9-20-16/h1-10H,(H,21,22,23)
InChIKeyIUKZARJQUYBWBV-UHFFFAOYSA-N
MW372.20 g/mol
LogP4.30
Rot. Bonds3

About N-(5-bromo-2-pyridinyl)-4-(3-fluoro-2-pyridinyl)benzamide

N-(5-bromo-2-pyridinyl)-4-(3-fluoro-2-pyridinyl)benzamide (PubChem CID 59673732) has the molecular formula C17H11BrFN3O and a molecular weight of 372.20 g/mol. Its IUPAC name is N-(5-bromo-2-pyridinyl)-4-(3-fluoro-2-pyridinyl)benzamide.

Molecular Properties

Compound NameN-(5-bromo-2-pyridinyl)-4-(3-fluoro-2-pyridinyl)benzamide
PubChem CID59673732
Molecular FormulaC17H11BrFN3O
Molecular Weight372.20 g/mol
Exact Mass371.01
IUPAC NameN-(5-bromo-2-pyridinyl)-4-(3-fluoro-2-pyridinyl)benzamide
SMILESO=C(Nc1ccc(Br)cn1)c1ccc(-c2ncccc2F)cc1
InChIInChI=1S/C17H11BrFN3O/c18-13-7-8-15(21-10-13)22-17(23)12-5-3-11(4-6-12)16-14(19)2-1-9-20-16/h1-10H,(H,21,22,23)
InChIKeyIUKZARJQUYBWBV-UHFFFAOYSA-N
XLogP4.30
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.20
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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N-(5-bromo-2-pyridinyl)-3,5-difluoro-4-hydrazinylbenzamide
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4-(3-methoxy-2-pyridinyl)-N-[5-(trifluoromethyl)-2-pyridinyl]benzamide
CID 59672591
N-(5-bromo-2-pyridinyl)-4-methylsulfonylbenzamide
CID 60650971
N-(4-cyclopentylphenyl)-4-(3-fluoro-2-pyridinyl)benzamide
CID 58639613
N-(5-bromo-2-pyridinyl)-3-[[4-(2-sulfamoylphenyl)benzoyl]amino]pyridine-2-carboxamide
CID 10302828
1-(5-bromo-2-pyridinyl)-3-[2-(3-fluoro-2-pyridinyl)ethyl]urea
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Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-2-pyridinyl)-4-(3-fluoro-2-pyridinyl)benzamide?
The IUPAC name of N-(5-bromo-2-pyridinyl)-4-(3-fluoro-2-pyridinyl)benzamide (CID 59673732) is N-(5-bromo-2-pyridinyl)-4-(3-fluoro-2-pyridinyl)benzamide.
What is the SMILES notation for N-(5-bromo-2-pyridinyl)-4-(3-fluoro-2-pyridinyl)benzamide?
The canonical SMILES for N-(5-bromo-2-pyridinyl)-4-(3-fluoro-2-pyridinyl)benzamide is O=C(Nc1ccc(Br)cn1)c1ccc(-c2ncccc2F)cc1.
What is the InChIKey of N-(5-bromo-2-pyridinyl)-4-(3-fluoro-2-pyridinyl)benzamide?
The InChIKey is IUKZARJQUYBWBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11BrFN3O/c18-13-7-8-15(21-10-13)22-17(23)12-5-3-11(4-6-12)16-14(19)2-1-9-20-16/h1-10H,(H,21,22,23).
What are the key properties of N-(5-bromo-2-pyridinyl)-4-(3-fluoro-2-pyridinyl)benzamide?
N-(5-bromo-2-pyridinyl)-4-(3-fluoro-2-pyridinyl)benzamide has a molecular weight of 372.20 g/mol, XLogP of 4.30, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-2-pyridinyl)-4-(3-fluoro-2-pyridinyl)benzamide is sourced from PubChem (CID 59673732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).