8-bromo-2-(2-methoxypropan-2-yl)quinolin-3-ol

C13H14BrNO2 — CID 165487257

IUPAC8-bromo-2-(2-methoxypropan-2-yl)quinolin-3-ol
SMILESCOC(C)(C)c1nc2c(Br)cccc2cc1O
InChIInChI=1S/C13H14BrNO2/c1-13(2,17-3)12-10(16)7-8-5-4-6-9(14)11(8)15-12/h4-7,16H,1-3H3
InChIKeyMXEAYTRDHWFWFN-UHFFFAOYSA-N
MW296.16 g/mol
LogP3.58
Rot. Bonds2

About 8-bromo-2-(2-methoxypropan-2-yl)quinolin-3-ol

8-bromo-2-(2-methoxypropan-2-yl)quinolin-3-ol (PubChem CID 165487257) has the molecular formula C13H14BrNO2 and a molecular weight of 296.16 g/mol. Its IUPAC name is 8-bromo-2-(2-methoxypropan-2-yl)quinolin-3-ol.

Molecular Properties

Compound Name8-bromo-2-(2-methoxypropan-2-yl)quinolin-3-ol
PubChem CID165487257
Molecular FormulaC13H14BrNO2
Molecular Weight296.16 g/mol
Exact Mass295.02
IUPAC Name8-bromo-2-(2-methoxypropan-2-yl)quinolin-3-ol
SMILESCOC(C)(C)c1nc2c(Br)cccc2cc1O
InChIInChI=1S/C13H14BrNO2/c1-13(2,17-3)12-10(16)7-8-5-4-6-9(14)11(8)15-12/h4-7,16H,1-3H3
InChIKeyMXEAYTRDHWFWFN-UHFFFAOYSA-N
XLogP3.58
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.16
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-chloro-2-(2-methoxypropan-2-yl)quinolin-3-ol
CID 165487643
2-tert-butyl-8-fluoroquinolin-3-ol
CID 165467627
7-fluoro-2-(2-methoxypropan-2-yl)quinolin-3-ol
CID 165476618
3-bromo-2-(2-methoxypropan-2-yl)pyridine
CID 151692049
methyl 8-bromocinnoline-3-carboxylate
CID 131494996
8-bromo-2-chloro-3-methoxyquinoline
CID 88869143
8-bromo-3-tert-butylquinolin-2-amine
CID 63382033
8-bromo-2,3-dimethylquinoline
CID 11402096
(2S)-1-[(8-bromoquinolin-2-yl)amino]-3-methoxypropan-2-ol
CID 97062756
methyl 8-bromo-2-(trifluoromethyl)quinoline-4-carboxylate
CID 10892971
2-[3-bromo-2-[2-bromo-6-(2-methoxypropan-2-yl)phenyl]phenyl]propan-2-ol
CID 84820615
3,8-dibromocinnoline
CID 22314224

Frequently Asked Questions

What is the IUPAC name of 8-bromo-2-(2-methoxypropan-2-yl)quinolin-3-ol?
The IUPAC name of 8-bromo-2-(2-methoxypropan-2-yl)quinolin-3-ol (CID 165487257) is 8-bromo-2-(2-methoxypropan-2-yl)quinolin-3-ol.
What is the SMILES notation for 8-bromo-2-(2-methoxypropan-2-yl)quinolin-3-ol?
The canonical SMILES for 8-bromo-2-(2-methoxypropan-2-yl)quinolin-3-ol is COC(C)(C)c1nc2c(Br)cccc2cc1O.
What is the InChIKey of 8-bromo-2-(2-methoxypropan-2-yl)quinolin-3-ol?
The InChIKey is MXEAYTRDHWFWFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14BrNO2/c1-13(2,17-3)12-10(16)7-8-5-4-6-9(14)11(8)15-12/h4-7,16H,1-3H3.
What are the key properties of 8-bromo-2-(2-methoxypropan-2-yl)quinolin-3-ol?
8-bromo-2-(2-methoxypropan-2-yl)quinolin-3-ol has a molecular weight of 296.16 g/mol, XLogP of 3.58, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-bromo-2-(2-methoxypropan-2-yl)quinolin-3-ol is sourced from PubChem (CID 165487257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).