3-bromo-7-propan-2-ylquinolin-6-ol

C12H12BrNO — CID 135041979

IUPAC3-bromo-7-propan-2-ylquinolin-6-ol
SMILESCC(C)c1cc2ncc(Br)cc2cc1O
InChIInChI=1S/C12H12BrNO/c1-7(2)10-5-11-8(4-12(10)15)3-9(13)6-14-11/h3-7,15H,1-2H3
InChIKeyUGBABPZEVGSJBT-UHFFFAOYSA-N
MW266.14 g/mol
LogP3.83
Rot. Bonds1

About 3-bromo-7-propan-2-ylquinolin-6-ol

3-bromo-7-propan-2-ylquinolin-6-ol (PubChem CID 135041979) has the molecular formula C12H12BrNO and a molecular weight of 266.14 g/mol. Its IUPAC name is 3-bromo-7-propan-2-ylquinolin-6-ol.

Molecular Properties

Compound Name3-bromo-7-propan-2-ylquinolin-6-ol
PubChem CID135041979
Molecular FormulaC12H12BrNO
Molecular Weight266.14 g/mol
Exact Mass265.01
IUPAC Name3-bromo-7-propan-2-ylquinolin-6-ol
SMILESCC(C)c1cc2ncc(Br)cc2cc1O
InChIInChI=1S/C12H12BrNO/c1-7(2)10-5-11-8(4-12(10)15)3-9(13)6-14-11/h3-7,15H,1-2H3
InChIKeyUGBABPZEVGSJBT-UHFFFAOYSA-N
XLogP3.83
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.14
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-bromo-7-methylquinolin-6-ol
CID 57418037
7-propan-2-ylquinolin-6-ol
CID 58826991
3-bromo-5-methylquinolin-6-ol
CID 170127970
6-bromo-2-propan-2-yl-1H-pyrrolo[3,2-b]pyridine
CID 123742080
1-methyl-6-propan-2-ylbenzimidazol-5-ol
CID 163425924
3-bromo-7-methoxyquinoline
CID 18788548
7-propan-2-ylnaphthalene-1,6-diol
CID 138738541
N-(3-bromoquinolin-6-yl)acetamide
CID 15378467
ethane;6-methoxy-3-propan-2-ylnaphthalen-2-ol
CID 143419787
methyl 3-bromoquinoline-7-carboxylate
CID 117100290
3-bromoquinoline;hydrobromide
CID 70190019
propan-2-yl 5-bromo-3-hydroxypyridine-2-carboxylate
CID 133062597

Frequently Asked Questions

What is the IUPAC name of 3-bromo-7-propan-2-ylquinolin-6-ol?
The IUPAC name of 3-bromo-7-propan-2-ylquinolin-6-ol (CID 135041979) is 3-bromo-7-propan-2-ylquinolin-6-ol.
What is the SMILES notation for 3-bromo-7-propan-2-ylquinolin-6-ol?
The canonical SMILES for 3-bromo-7-propan-2-ylquinolin-6-ol is CC(C)c1cc2ncc(Br)cc2cc1O.
What is the InChIKey of 3-bromo-7-propan-2-ylquinolin-6-ol?
The InChIKey is UGBABPZEVGSJBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12BrNO/c1-7(2)10-5-11-8(4-12(10)15)3-9(13)6-14-11/h3-7,15H,1-2H3.
What are the key properties of 3-bromo-7-propan-2-ylquinolin-6-ol?
3-bromo-7-propan-2-ylquinolin-6-ol has a molecular weight of 266.14 g/mol, XLogP of 3.83, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-7-propan-2-ylquinolin-6-ol is sourced from PubChem (CID 135041979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).