2-(bromomethyl)-6-phenylpyridin-3-ol

C12H10BrNO — CID 131609645

IUPAC2-(bromomethyl)-6-phenylpyridin-3-ol
SMILESOc1ccc(-c2ccccc2)nc1CBr
InChIInChI=1S/C12H10BrNO/c13-8-11-12(15)7-6-10(14-11)9-4-2-1-3-5-9/h1-7,15H,8H2
InChIKeyDXHIGTPNOQPROJ-UHFFFAOYSA-N
MW264.12 g/mol
LogP3.35
Rot. Bonds2

About 2-(bromomethyl)-6-phenylpyridin-3-ol

2-(bromomethyl)-6-phenylpyridin-3-ol (PubChem CID 131609645) has the molecular formula C12H10BrNO and a molecular weight of 264.12 g/mol. Its IUPAC name is 2-(bromomethyl)-6-phenylpyridin-3-ol.

Molecular Properties

Compound Name2-(bromomethyl)-6-phenylpyridin-3-ol
PubChem CID131609645
Molecular FormulaC12H10BrNO
Molecular Weight264.12 g/mol
Exact Mass262.99
IUPAC Name2-(bromomethyl)-6-phenylpyridin-3-ol
SMILESOc1ccc(-c2ccccc2)nc1CBr
InChIInChI=1S/C12H10BrNO/c13-8-11-12(15)7-6-10(14-11)9-4-2-1-3-5-9/h1-7,15H,8H2
InChIKeyDXHIGTPNOQPROJ-UHFFFAOYSA-N
XLogP3.35
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.12
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

[2-(bromomethyl)-6-phenyl-3-pyridinyl]carbamic acid
CID 69313732
2-ethyl-6-phenylpyridine-3-carboxylic acid
CID 91810897
4-(bromomethyl)-6-phenylpyridin-3-ol
CID 131609639
6-phenyl-2-propylpyridine-3-carboxylic acid
CID 112693851
6-(4-fluorophenyl)-2-phenylpyridin-3-ol
CID 132609684
2,3-bis(chloromethyl)-6-phenylpyridine
CID 18916594
1-(3-amino-6-phenyl-2-pyridinyl)propan-2-one;ethane
CID 161306224
[2-(hydroxymethyl)-6-phenyl-3-pyridinyl]carbamic acid
CID 69317390
6-(bromomethyl)-5-phenylpyridin-3-ol
CID 131609641
3-bromo-2,6-diphenylpyridine
CID 56839636
ethyl 2-amino-6-phenylpyridine-3-carboxylate
CID 1236695
2-ethoxy-6-phenylpyridine
CID 58166184

Frequently Asked Questions

What is the IUPAC name of 2-(bromomethyl)-6-phenylpyridin-3-ol?
The IUPAC name of 2-(bromomethyl)-6-phenylpyridin-3-ol (CID 131609645) is 2-(bromomethyl)-6-phenylpyridin-3-ol.
What is the SMILES notation for 2-(bromomethyl)-6-phenylpyridin-3-ol?
The canonical SMILES for 2-(bromomethyl)-6-phenylpyridin-3-ol is Oc1ccc(-c2ccccc2)nc1CBr.
What is the InChIKey of 2-(bromomethyl)-6-phenylpyridin-3-ol?
The InChIKey is DXHIGTPNOQPROJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10BrNO/c13-8-11-12(15)7-6-10(14-11)9-4-2-1-3-5-9/h1-7,15H,8H2.
What are the key properties of 2-(bromomethyl)-6-phenylpyridin-3-ol?
2-(bromomethyl)-6-phenylpyridin-3-ol has a molecular weight of 264.12 g/mol, XLogP of 3.35, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(bromomethyl)-6-phenylpyridin-3-ol is sourced from PubChem (CID 131609645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).