5,7-dibromo-8-methoxyquinoline

C10H7Br2NO — CID 10805403

IUPAC5,7-dibromo-8-methoxyquinoline
SMILESCOc1c(Br)cc(Br)c2cccnc12
InChIInChI=1S/C10H7Br2NO/c1-14-10-8(12)5-7(11)6-3-2-4-13-9(6)10/h2-5H,1H3
InChIKeyIJANXCJVULGZRF-UHFFFAOYSA-N
MW316.98 g/mol
LogP3.77
Rot. Bonds1

About 5,7-dibromo-8-methoxyquinoline

5,7-dibromo-8-methoxyquinoline (PubChem CID 10805403) has the molecular formula C10H7Br2NO and a molecular weight of 316.98 g/mol. Its IUPAC name is 5,7-dibromo-8-methoxyquinoline.

Molecular Properties

Compound Name5,7-dibromo-8-methoxyquinoline
PubChem CID10805403
Molecular FormulaC10H7Br2NO
Molecular Weight316.98 g/mol
Exact Mass314.89
IUPAC Name5,7-dibromo-8-methoxyquinoline
SMILESCOc1c(Br)cc(Br)c2cccnc12
InChIInChI=1S/C10H7Br2NO/c1-14-10-8(12)5-7(11)6-3-2-4-13-9(6)10/h2-5H,1H3
InChIKeyIJANXCJVULGZRF-UHFFFAOYSA-N
XLogP3.77
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.98
LogP ≤ 53.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-bromo-8-methoxy-7-methylquinoline
CID 90145888
7-bromo-5-chloro-8-methoxyquinoline
CID 58763008
5,7-dibromo-8-but-2-enoxyquinoline
CID 4859559
3-(5,7-dibromoquinolin-8-yl)oxy-N-methylpropan-1-amine
CID 62597922
4-(5,7-dibromoquinolin-8-yl)oxybutan-1-amine
CID 62597239
N-[2-(5,7-dibromoquinolin-8-yl)oxyethyl]propan-2-amine
CID 55093115
2-(5,7-dibromoquinolin-8-yl)oxy-N-methylacetamide
CID 7866129
7-bromo-8-methoxy-6H-1,6-naphthyridin-5-one
CID 142818668
2-(5,7-dibromoquinolin-8-yl)oxy-N-(2-methoxyphenyl)acetamide
CID 91455867
4-(5,7-dibromoquinolin-8-yl)oxy-N-propylbutan-1-amine
CID 62597073
(5,7-dibromoquinolin-8-yl) 5-ethyl-2-methoxybenzenesulfonate
CID 35203632
N-[2-(5,7-dibromoquinolin-8-yl)oxypropyl]butan-2-amine
CID 63516068

Frequently Asked Questions

What is the IUPAC name of 5,7-dibromo-8-methoxyquinoline?
The IUPAC name of 5,7-dibromo-8-methoxyquinoline (CID 10805403) is 5,7-dibromo-8-methoxyquinoline.
What is the SMILES notation for 5,7-dibromo-8-methoxyquinoline?
The canonical SMILES for 5,7-dibromo-8-methoxyquinoline is COc1c(Br)cc(Br)c2cccnc12.
What is the InChIKey of 5,7-dibromo-8-methoxyquinoline?
The InChIKey is IJANXCJVULGZRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7Br2NO/c1-14-10-8(12)5-7(11)6-3-2-4-13-9(6)10/h2-5H,1H3.
What are the key properties of 5,7-dibromo-8-methoxyquinoline?
5,7-dibromo-8-methoxyquinoline has a molecular weight of 316.98 g/mol, XLogP of 3.77, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,7-dibromo-8-methoxyquinoline is sourced from PubChem (CID 10805403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).