5-bromo-2-(4-hydroxyphenyl)quinolin-6-ol

C15H10BrNO2 — CID 135421237

IUPAC5-bromo-2-(4-hydroxyphenyl)quinolin-6-ol
SMILESOc1ccc(-c2ccc3c(Br)c(O)ccc3n2)cc1
InChIInChI=1S/C15H10BrNO2/c16-15-11-5-6-12(9-1-3-10(18)4-2-9)17-13(11)7-8-14(15)19/h1-8,18-19H
InChIKeyBLXVDNNULRNBGB-UHFFFAOYSA-N
MW316.15 g/mol
LogP4.08
Rot. Bonds1

About 5-bromo-2-(4-hydroxyphenyl)quinolin-6-ol

5-bromo-2-(4-hydroxyphenyl)quinolin-6-ol (PubChem CID 135421237) has the molecular formula C15H10BrNO2 and a molecular weight of 316.15 g/mol. Its IUPAC name is 5-bromo-2-(4-hydroxyphenyl)quinolin-6-ol.

Molecular Properties

Compound Name5-bromo-2-(4-hydroxyphenyl)quinolin-6-ol
PubChem CID135421237
Molecular FormulaC15H10BrNO2
Molecular Weight316.15 g/mol
Exact Mass314.99
IUPAC Name5-bromo-2-(4-hydroxyphenyl)quinolin-6-ol
SMILESOc1ccc(-c2ccc3c(Br)c(O)ccc3n2)cc1
InChIInChI=1S/C15H10BrNO2/c16-15-11-5-6-12(9-1-3-10(18)4-2-9)17-13(11)7-8-14(15)19/h1-8,18-19H
InChIKeyBLXVDNNULRNBGB-UHFFFAOYSA-N
XLogP4.08
TPSA53.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.15
LogP ≤ 54.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-(4-hydroxyphenyl)quinolin-6-ol?
The IUPAC name of 5-bromo-2-(4-hydroxyphenyl)quinolin-6-ol (CID 135421237) is 5-bromo-2-(4-hydroxyphenyl)quinolin-6-ol.
What is the SMILES notation for 5-bromo-2-(4-hydroxyphenyl)quinolin-6-ol?
The canonical SMILES for 5-bromo-2-(4-hydroxyphenyl)quinolin-6-ol is Oc1ccc(-c2ccc3c(Br)c(O)ccc3n2)cc1.
What is the InChIKey of 5-bromo-2-(4-hydroxyphenyl)quinolin-6-ol?
The InChIKey is BLXVDNNULRNBGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10BrNO2/c16-15-11-5-6-12(9-1-3-10(18)4-2-9)17-13(11)7-8-14(15)19/h1-8,18-19H.
What are the key properties of 5-bromo-2-(4-hydroxyphenyl)quinolin-6-ol?
5-bromo-2-(4-hydroxyphenyl)quinolin-6-ol has a molecular weight of 316.15 g/mol, XLogP of 4.08, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-(4-hydroxyphenyl)quinolin-6-ol is sourced from PubChem (CID 135421237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).