[6-(3-bromophenoxy)-3-pyridinyl]methanol

C12H10BrNO2 — CID 61255243

IUPAC[6-(3-bromophenoxy)-3-pyridinyl]methanol
SMILESOCc1ccc(Oc2cccc(Br)c2)nc1
InChIInChI=1S/C12H10BrNO2/c13-10-2-1-3-11(6-10)16-12-5-4-9(8-15)7-14-12/h1-7,15H,8H2
InChIKeyWHWLAKNDKPOMMF-UHFFFAOYSA-N
MW280.12 g/mol
LogP3.13
Rot. Bonds3

About [6-(3-bromophenoxy)-3-pyridinyl]methanol

[6-(3-bromophenoxy)-3-pyridinyl]methanol (PubChem CID 61255243) has the molecular formula C12H10BrNO2 and a molecular weight of 280.12 g/mol. Its IUPAC name is [6-(3-bromophenoxy)-3-pyridinyl]methanol.

Molecular Properties

Compound Name[6-(3-bromophenoxy)-3-pyridinyl]methanol
PubChem CID61255243
Molecular FormulaC12H10BrNO2
Molecular Weight280.12 g/mol
Exact Mass278.99
IUPAC Name[6-(3-bromophenoxy)-3-pyridinyl]methanol
SMILESOCc1ccc(Oc2cccc(Br)c2)nc1
InChIInChI=1S/C12H10BrNO2/c13-10-2-1-3-11(6-10)16-12-5-4-9(8-15)7-14-12/h1-7,15H,8H2
InChIKeyWHWLAKNDKPOMMF-UHFFFAOYSA-N
XLogP3.13
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.12
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[6-(3-bromophenoxy)-3-pyridinyl]-N-methylmethanamine
CID 55058512
[6-(3-aminophenoxy)-3-pyridinyl]methanol
CID 89089280
2-(3-bromophenoxy)-5-methoxypyridine
CID 106503836
[6-[3-(methoxymethyl)phenoxy]-3-pyridinyl]methanol
CID 63986464
[4-[(5-bromo-2-pyridinyl)oxy]phenyl]methanol
CID 61373994
[6-(3-bromophenoxy)pyrazin-2-yl]methanol
CID 66466850
[4-[2-(3-bromophenoxy)ethoxy]phenyl]methanol
CID 60627615
6-(3-bromophenoxy)pyridine-3-sulfonyl chloride
CID 112572590
6-(3-bromophenoxy)-N-(1-hydroxypropan-2-yl)pyridine-3-carboxamide
CID 78887929
5-(bromomethyl)-2-(3-chlorophenoxy)pyridine
CID 107087158
5-(bromomethyl)-2-(6-bromonaphthalen-2-yl)oxypyridine
CID 107087262
[3-[(5-bromo-4-methyl-2-pyridinyl)oxy]phenyl]methanol
CID 114869670

Frequently Asked Questions

What is the IUPAC name of [6-(3-bromophenoxy)-3-pyridinyl]methanol?
The IUPAC name of [6-(3-bromophenoxy)-3-pyridinyl]methanol (CID 61255243) is [6-(3-bromophenoxy)-3-pyridinyl]methanol.
What is the SMILES notation for [6-(3-bromophenoxy)-3-pyridinyl]methanol?
The canonical SMILES for [6-(3-bromophenoxy)-3-pyridinyl]methanol is OCc1ccc(Oc2cccc(Br)c2)nc1.
What is the InChIKey of [6-(3-bromophenoxy)-3-pyridinyl]methanol?
The InChIKey is WHWLAKNDKPOMMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10BrNO2/c13-10-2-1-3-11(6-10)16-12-5-4-9(8-15)7-14-12/h1-7,15H,8H2.
What are the key properties of [6-(3-bromophenoxy)-3-pyridinyl]methanol?
[6-(3-bromophenoxy)-3-pyridinyl]methanol has a molecular weight of 280.12 g/mol, XLogP of 3.13, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(3-bromophenoxy)-3-pyridinyl]methanol is sourced from PubChem (CID 61255243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).