3-[(5-bromo-2-pyridinyl)methoxy]quinoline

C15H11BrN2O — CID 107388127

IUPAC3-[(5-bromo-2-pyridinyl)methoxy]quinoline
SMILESBrc1ccc(COc2cnc3ccccc3c2)nc1
InChIInChI=1S/C15H11BrN2O/c16-12-5-6-13(17-8-12)10-19-14-7-11-3-1-2-4-15(11)18-9-14/h1-9H,10H2
InChIKeyFPGUMSVAGSGQSD-UHFFFAOYSA-N
MW315.17 g/mol
LogP3.97
Rot. Bonds3

About 3-[(5-bromo-2-pyridinyl)methoxy]quinoline

3-[(5-bromo-2-pyridinyl)methoxy]quinoline (PubChem CID 107388127) has the molecular formula C15H11BrN2O and a molecular weight of 315.17 g/mol. Its IUPAC name is 3-[(5-bromo-2-pyridinyl)methoxy]quinoline.

Molecular Properties

Compound Name3-[(5-bromo-2-pyridinyl)methoxy]quinoline
PubChem CID107388127
Molecular FormulaC15H11BrN2O
Molecular Weight315.17 g/mol
Exact Mass314.01
IUPAC Name3-[(5-bromo-2-pyridinyl)methoxy]quinoline
SMILESBrc1ccc(COc2cnc3ccccc3c2)nc1
InChIInChI=1S/C15H11BrN2O/c16-12-5-6-13(17-8-12)10-19-14-7-11-3-1-2-4-15(11)18-9-14/h1-9H,10H2
InChIKeyFPGUMSVAGSGQSD-UHFFFAOYSA-N
XLogP3.97
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.17
LogP ≤ 53.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-(bromomethoxy)quinoline
CID 54277099
5-bromo-2-[(3-bromophenoxy)methyl]pyridine
CID 104797443
3-bromoquinoline;hydrobromide
CID 70190019
(4-bromo-2-quinolin-3-yloxyphenyl)methanamine
CID 107386867
2-ethyl-4-(quinolin-3-yloxymethyl)-1,3-thiazole
CID 102846975
2-quinolin-3-yloxyethanol
CID 102847036
2-quinolin-3-yloxyethanamine
CID 84661473
3-(quinolin-3-yloxymethyl)-1,2,4-oxadiazole
CID 107388095
3-prop-2-ynoxyquinoline
CID 102847055
3-[(2,4-dichlorophenyl)methoxy]quinoline
CID 107388172
6-quinolin-3-yloxyhexane-1-sulfonamide
CID 107388061
3-(3,3,3-trifluoropropoxy)quinoline
CID 102846999

Frequently Asked Questions

What is the IUPAC name of 3-[(5-bromo-2-pyridinyl)methoxy]quinoline?
The IUPAC name of 3-[(5-bromo-2-pyridinyl)methoxy]quinoline (CID 107388127) is 3-[(5-bromo-2-pyridinyl)methoxy]quinoline.
What is the SMILES notation for 3-[(5-bromo-2-pyridinyl)methoxy]quinoline?
The canonical SMILES for 3-[(5-bromo-2-pyridinyl)methoxy]quinoline is Brc1ccc(COc2cnc3ccccc3c2)nc1.
What is the InChIKey of 3-[(5-bromo-2-pyridinyl)methoxy]quinoline?
The InChIKey is FPGUMSVAGSGQSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11BrN2O/c16-12-5-6-13(17-8-12)10-19-14-7-11-3-1-2-4-15(11)18-9-14/h1-9H,10H2.
What are the key properties of 3-[(5-bromo-2-pyridinyl)methoxy]quinoline?
3-[(5-bromo-2-pyridinyl)methoxy]quinoline has a molecular weight of 315.17 g/mol, XLogP of 3.97, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(5-bromo-2-pyridinyl)methoxy]quinoline is sourced from PubChem (CID 107388127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).