N-(3-bromo-5-methyl-2-pyridinyl)benzamide

C13H11BrN2O — CID 2811520

IUPACN-(3-bromo-5-methyl-2-pyridinyl)benzamide
SMILESCc1cnc(NC(=O)c2ccccc2)c(Br)c1
InChIInChI=1S/C13H11BrN2O/c1-9-7-11(14)12(15-8-9)16-13(17)10-5-3-2-4-6-10/h2-8H,1H3,(H,15,16,17)
InChIKeyOBKDVIFDJZTEIM-UHFFFAOYSA-N
MW291.15 g/mol
LogP3.40
Rot. Bonds2

About N-(3-bromo-5-methyl-2-pyridinyl)benzamide

N-(3-bromo-5-methyl-2-pyridinyl)benzamide (PubChem CID 2811520) has the molecular formula C13H11BrN2O and a molecular weight of 291.15 g/mol. Its IUPAC name is N-(3-bromo-5-methyl-2-pyridinyl)benzamide.

Molecular Properties

Compound NameN-(3-bromo-5-methyl-2-pyridinyl)benzamide
PubChem CID2811520
Molecular FormulaC13H11BrN2O
Molecular Weight291.15 g/mol
Exact Mass290.01
IUPAC NameN-(3-bromo-5-methyl-2-pyridinyl)benzamide
SMILESCc1cnc(NC(=O)c2ccccc2)c(Br)c1
InChIInChI=1S/C13H11BrN2O/c1-9-7-11(14)12(15-8-9)16-13(17)10-5-3-2-4-6-10/h2-8H,1H3,(H,15,16,17)
InChIKeyOBKDVIFDJZTEIM-UHFFFAOYSA-N
XLogP3.40
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.15
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(pyridin-2-yl)benzamide
CID 219990
4-Aminobenzamidopyridine
CID 81976
4-propan-2-yl-N-pyridin-2-ylbenzamide
CID 898760
N-Benzoyl-N'-(2-pyridinyl)thiourea
CID 708470
2-methyl-N-pyridin-2-ylbenzamide
CID 799062
3-bromo-N-(6-methylpyridin-2-yl)benzamide
CID 603306
3-(2-{[(5-bromopyridin-2-yl)carbamothioyl]amino}ethyl)-2,4-difluoro-N-methylbenzamide
CID 3001079
N-(5-Bromo-2-pyridinyl)-1-naphthamide
CID 593268
(E)-1-(4-bromophenyl)-3-[(4-methylpyridin-2-yl)amino]prop-2-en-1-one
CID 1927167
N-(pyridin-2-yl)biphenyl-4-carboxamide
CID 669449
N-(pyridin-2-ylcarbamoyl)benzamide
CID 2985532
Benzamide, 4-(acetylamino)-N-2-pyridinyl-
CID 215925

Frequently Asked Questions

What is the IUPAC name of N-(3-bromo-5-methyl-2-pyridinyl)benzamide?
The IUPAC name of N-(3-bromo-5-methyl-2-pyridinyl)benzamide (CID 2811520) is N-(3-bromo-5-methyl-2-pyridinyl)benzamide.
What is the SMILES notation for N-(3-bromo-5-methyl-2-pyridinyl)benzamide?
The canonical SMILES for N-(3-bromo-5-methyl-2-pyridinyl)benzamide is Cc1cnc(NC(=O)c2ccccc2)c(Br)c1.
What is the InChIKey of N-(3-bromo-5-methyl-2-pyridinyl)benzamide?
The InChIKey is OBKDVIFDJZTEIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11BrN2O/c1-9-7-11(14)12(15-8-9)16-13(17)10-5-3-2-4-6-10/h2-8H,1H3,(H,15,16,17).
What are the key properties of N-(3-bromo-5-methyl-2-pyridinyl)benzamide?
N-(3-bromo-5-methyl-2-pyridinyl)benzamide has a molecular weight of 291.15 g/mol, XLogP of 3.40, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-bromo-5-methyl-2-pyridinyl)benzamide is sourced from PubChem (CID 2811520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).