4-bromo-3-hydroxy-N-quinolin-8-ylbenzamide

C16H11BrN2O2 — CID 103871242

IUPAC4-bromo-3-hydroxy-N-quinolin-8-ylbenzamide
SMILESO=C(Nc1cccc2cccnc12)c1ccc(Br)c(O)c1
InChIInChI=1S/C16H11BrN2O2/c17-12-7-6-11(9-14(12)20)16(21)19-13-5-1-3-10-4-2-8-18-15(10)13/h1-9,20H,(H,19,21)
InChIKeyLQLRDODMQRFUGU-UHFFFAOYSA-N
MW343.18 g/mol
LogP3.96
Rot. Bonds2

About 4-bromo-3-hydroxy-N-quinolin-8-ylbenzamide

4-bromo-3-hydroxy-N-quinolin-8-ylbenzamide (PubChem CID 103871242) has the molecular formula C16H11BrN2O2 and a molecular weight of 343.18 g/mol. Its IUPAC name is 4-bromo-3-hydroxy-N-quinolin-8-ylbenzamide.

Molecular Properties

Compound Name4-bromo-3-hydroxy-N-quinolin-8-ylbenzamide
PubChem CID103871242
Molecular FormulaC16H11BrN2O2
Molecular Weight343.18 g/mol
Exact Mass342.00
IUPAC Name4-bromo-3-hydroxy-N-quinolin-8-ylbenzamide
SMILESO=C(Nc1cccc2cccnc12)c1ccc(Br)c(O)c1
InChIInChI=1S/C16H11BrN2O2/c17-12-7-6-11(9-14(12)20)16(21)19-13-5-1-3-10-4-2-8-18-15(10)13/h1-9,20H,(H,19,21)
InChIKeyLQLRDODMQRFUGU-UHFFFAOYSA-N
XLogP3.96
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.18
LogP ≤ 53.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-bromo-3-hydroxy-N-(2-methyl-3-pyridinyl)benzamide
CID 103957362
2-bromo-6-hydroxy-N-quinolin-8-ylbenzamide
CID 174610823
6-bromo-N-quinolin-8-ylpyridine-3-carboxamide
CID 66463068
5-bromo-N-quinolin-8-ylpyridine-3-carboxamide
CID 837055
N-quinolin-8-yl-1H-indole-5-carboxamide
CID 110694998
2-hydrazinyl-N-quinolin-8-ylpyridine-4-carboxamide
CID 62235936
1,3-dimethyl-2-oxo-N-quinolin-8-ylbenzimidazole-5-carboxamide
CID 110765475
5-iodo-N-quinolin-8-ylthiophene-3-carboxamide
CID 78948742
2-amino-3-bromo-N-quinolin-8-ylbenzamide
CID 110451344
1-N-(2-cyanophenyl)-4-N-quinolin-8-ylbenzene-1,4-dicarboxamide
CID 109050221
5-methyl-N-quinolin-8-ylthiophene-3-carboxamide
CID 166451949
N-(2-aminophenyl)-4-bromo-3-hydroxybenzamide
CID 114103160

Frequently Asked Questions

What is the IUPAC name of 4-bromo-3-hydroxy-N-quinolin-8-ylbenzamide?
The IUPAC name of 4-bromo-3-hydroxy-N-quinolin-8-ylbenzamide (CID 103871242) is 4-bromo-3-hydroxy-N-quinolin-8-ylbenzamide.
What is the SMILES notation for 4-bromo-3-hydroxy-N-quinolin-8-ylbenzamide?
The canonical SMILES for 4-bromo-3-hydroxy-N-quinolin-8-ylbenzamide is O=C(Nc1cccc2cccnc12)c1ccc(Br)c(O)c1.
What is the InChIKey of 4-bromo-3-hydroxy-N-quinolin-8-ylbenzamide?
The InChIKey is LQLRDODMQRFUGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11BrN2O2/c17-12-7-6-11(9-14(12)20)16(21)19-13-5-1-3-10-4-2-8-18-15(10)13/h1-9,20H,(H,19,21).
What are the key properties of 4-bromo-3-hydroxy-N-quinolin-8-ylbenzamide?
4-bromo-3-hydroxy-N-quinolin-8-ylbenzamide has a molecular weight of 343.18 g/mol, XLogP of 3.96, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-3-hydroxy-N-quinolin-8-ylbenzamide is sourced from PubChem (CID 103871242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).