N-(5-bromo-2-pyridinyl)-4-hydroxy-3-methylbenzamide

C13H11BrN2O2 — CID 103956611

IUPACN-(5-bromo-2-pyridinyl)-4-hydroxy-3-methylbenzamide
SMILESCc1cc(C(=O)Nc2ccc(Br)cn2)ccc1O
InChIInChI=1S/C13H11BrN2O2/c1-8-6-9(2-4-11(8)17)13(18)16-12-5-3-10(14)7-15-12/h2-7,17H,1H3,(H,15,16,18)
InChIKeyRBBBQBWXKPWOSV-UHFFFAOYSA-N
MW307.15 g/mol
LogP3.11
Rot. Bonds2

About N-(5-bromo-2-pyridinyl)-4-hydroxy-3-methylbenzamide

N-(5-bromo-2-pyridinyl)-4-hydroxy-3-methylbenzamide (PubChem CID 103956611) has the molecular formula C13H11BrN2O2 and a molecular weight of 307.15 g/mol. Its IUPAC name is N-(5-bromo-2-pyridinyl)-4-hydroxy-3-methylbenzamide.

Molecular Properties

Compound NameN-(5-bromo-2-pyridinyl)-4-hydroxy-3-methylbenzamide
PubChem CID103956611
Molecular FormulaC13H11BrN2O2
Molecular Weight307.15 g/mol
Exact Mass306.00
IUPAC NameN-(5-bromo-2-pyridinyl)-4-hydroxy-3-methylbenzamide
SMILESCc1cc(C(=O)Nc2ccc(Br)cn2)ccc1O
InChIInChI=1S/C13H11BrN2O2/c1-8-6-9(2-4-11(8)17)13(18)16-12-5-3-10(14)7-15-12/h2-7,17H,1H3,(H,15,16,18)
InChIKeyRBBBQBWXKPWOSV-UHFFFAOYSA-N
XLogP3.11
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.15
LogP ≤ 53.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-bromo-2-pyridinyl)-4-hydrazinyl-3-methylbenzamide
CID 63212020
N-(4-bromo-2-pyridinyl)-4-hydroxy-3-methylbenzamide
CID 107674194
4-amino-N-(5-bromo-2-pyridinyl)-3-hydroxybenzamide
CID 107073952
N-(5-bromo-2-pyridinyl)-3,5-dimethylbenzamide
CID 953685
N-(5-bromo-2-pyridinyl)-3-methyl-4-(tetrazol-1-yl)benzamide
CID 55773373
4-bromo-3-methyl-N-(5-methyl-2-pyridinyl)benzamide
CID 113338779
3-bromo-N-(5-bromo-2-pyridinyl)-4-methoxybenzamide
CID 23935414
N-(5-bromo-2-pyridinyl)-2,6-dichloropyridine-4-carboxamide
CID 43132088
N-(5-bromo-2-pyridinyl)-5-methylthiophene-3-carboxamide
CID 17218099
N-(5-bromo-2-pyridinyl)-4-iodobenzamide
CID 4066488
N-(5-bromo-2-pyridinyl)-4-propan-2-ylbenzamide
CID 60522017
4-hydroxy-3-methyl-N-(5-methyl-1H-pyrazol-3-yl)benzamide
CID 113357499

Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-2-pyridinyl)-4-hydroxy-3-methylbenzamide?
The IUPAC name of N-(5-bromo-2-pyridinyl)-4-hydroxy-3-methylbenzamide (CID 103956611) is N-(5-bromo-2-pyridinyl)-4-hydroxy-3-methylbenzamide.
What is the SMILES notation for N-(5-bromo-2-pyridinyl)-4-hydroxy-3-methylbenzamide?
The canonical SMILES for N-(5-bromo-2-pyridinyl)-4-hydroxy-3-methylbenzamide is Cc1cc(C(=O)Nc2ccc(Br)cn2)ccc1O.
What is the InChIKey of N-(5-bromo-2-pyridinyl)-4-hydroxy-3-methylbenzamide?
The InChIKey is RBBBQBWXKPWOSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11BrN2O2/c1-8-6-9(2-4-11(8)17)13(18)16-12-5-3-10(14)7-15-12/h2-7,17H,1H3,(H,15,16,18).
What are the key properties of N-(5-bromo-2-pyridinyl)-4-hydroxy-3-methylbenzamide?
N-(5-bromo-2-pyridinyl)-4-hydroxy-3-methylbenzamide has a molecular weight of 307.15 g/mol, XLogP of 3.11, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-2-pyridinyl)-4-hydroxy-3-methylbenzamide is sourced from PubChem (CID 103956611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).