[2-(3-bromophenoxy)-3-pyridinyl]methanol

C12H10BrNO2 — CID 61258163

IUPAC[2-(3-bromophenoxy)-3-pyridinyl]methanol
SMILESOCc1cccnc1Oc1cccc(Br)c1
InChIInChI=1S/C12H10BrNO2/c13-10-4-1-5-11(7-10)16-12-9(8-15)3-2-6-14-12/h1-7,15H,8H2
InChIKeyHIEYWHLFODNPFY-UHFFFAOYSA-N
MW280.12 g/mol
LogP3.13
Rot. Bonds3

About [2-(3-bromophenoxy)-3-pyridinyl]methanol

[2-(3-bromophenoxy)-3-pyridinyl]methanol (PubChem CID 61258163) has the molecular formula C12H10BrNO2 and a molecular weight of 280.12 g/mol. Its IUPAC name is [2-(3-bromophenoxy)-3-pyridinyl]methanol.

Molecular Properties

Compound Name[2-(3-bromophenoxy)-3-pyridinyl]methanol
PubChem CID61258163
Molecular FormulaC12H10BrNO2
Molecular Weight280.12 g/mol
Exact Mass278.99
IUPAC Name[2-(3-bromophenoxy)-3-pyridinyl]methanol
SMILESOCc1cccnc1Oc1cccc(Br)c1
InChIInChI=1S/C12H10BrNO2/c13-10-4-1-5-11(7-10)16-12-9(8-15)3-2-6-14-12/h1-7,15H,8H2
InChIKeyHIEYWHLFODNPFY-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

[2-(3-ethylphenoxy)-3-pyridinyl]methanol
CID 61257308
1-[2-(3-bromophenoxy)-3-pyridinyl]propan-2-amine
CID 114057557
2-(3-bromophenoxy)pyridin-3-amine
CID 16782330
[2-(2,3-dihydro-1H-inden-5-yloxy)-3-pyridinyl]methanol
CID 61257544
[2-(2-bromophenoxy)-3-pyridinyl]methanol
CID 61256696
[5-bromo-2-(3-bromophenoxy)phenyl]methanol
CID 114061472
[2-[2-(hydroxymethyl)phenoxy]-3-pyridinyl]methanol
CID 63653116
4-[[3-(hydroxymethyl)-2-pyridinyl]oxy]benzonitrile
CID 114056436
3-(3-bromophenoxy)pyrazine-2-carboxamide
CID 62684983
[6-(3-bromophenoxy)-3-pyridinyl]methanol
CID 61255243
3-(chloromethyl)-2-(3-chlorophenoxy)pyridine
CID 61267697
2-(3-bromophenoxy)-N-methyl-N-propan-2-ylpyridine-3-carboxamide
CID 78883963

Frequently Asked Questions

What is the IUPAC name of [2-(3-bromophenoxy)-3-pyridinyl]methanol?
The IUPAC name of [2-(3-bromophenoxy)-3-pyridinyl]methanol (CID 61258163) is [2-(3-bromophenoxy)-3-pyridinyl]methanol.
What is the SMILES notation for [2-(3-bromophenoxy)-3-pyridinyl]methanol?
The canonical SMILES for [2-(3-bromophenoxy)-3-pyridinyl]methanol is OCc1cccnc1Oc1cccc(Br)c1.
What is the InChIKey of [2-(3-bromophenoxy)-3-pyridinyl]methanol?
The InChIKey is HIEYWHLFODNPFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10BrNO2/c13-10-4-1-5-11(7-10)16-12-9(8-15)3-2-6-14-12/h1-7,15H,8H2.
What are the key properties of [2-(3-bromophenoxy)-3-pyridinyl]methanol?
[2-(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 [2-(3-bromophenoxy)-3-pyridinyl]methanol is sourced from PubChem (CID 61258163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).