2-bromo-5,6-dimethylpyridin-3-ol

C7H8BrNO — CID 130119183

IUPAC2-bromo-5,6-dimethylpyridin-3-ol
SMILESCc1cc(O)c(Br)nc1C
InChIInChI=1S/C7H8BrNO/c1-4-3-6(10)7(8)9-5(4)2/h3,10H,1-2H3
InChIKeyZDYVUYLYVJPQTI-UHFFFAOYSA-N
MW202.05 g/mol
LogP2.17
Rot. Bonds

About 2-bromo-5,6-dimethylpyridin-3-ol

2-bromo-5,6-dimethylpyridin-3-ol (PubChem CID 130119183) has the molecular formula C7H8BrNO and a molecular weight of 202.05 g/mol. Its IUPAC name is 2-bromo-5,6-dimethylpyridin-3-ol.

Molecular Properties

Compound Name2-bromo-5,6-dimethylpyridin-3-ol
PubChem CID130119183
Molecular FormulaC7H8BrNO
Molecular Weight202.05 g/mol
Exact Mass200.98
IUPAC Name2-bromo-5,6-dimethylpyridin-3-ol
SMILESCc1cc(O)c(Br)nc1C
InChIInChI=1S/C7H8BrNO/c1-4-3-6(10)7(8)9-5(4)2/h3,10H,1-2H3
InChIKeyZDYVUYLYVJPQTI-UHFFFAOYSA-N
XLogP2.17
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.05
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-bromo-5,6-dimethylpyridin-3-ol?
The IUPAC name of 2-bromo-5,6-dimethylpyridin-3-ol (CID 130119183) is 2-bromo-5,6-dimethylpyridin-3-ol.
What is the SMILES notation for 2-bromo-5,6-dimethylpyridin-3-ol?
The canonical SMILES for 2-bromo-5,6-dimethylpyridin-3-ol is Cc1cc(O)c(Br)nc1C.
What is the InChIKey of 2-bromo-5,6-dimethylpyridin-3-ol?
The InChIKey is ZDYVUYLYVJPQTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8BrNO/c1-4-3-6(10)7(8)9-5(4)2/h3,10H,1-2H3.
What are the key properties of 2-bromo-5,6-dimethylpyridin-3-ol?
2-bromo-5,6-dimethylpyridin-3-ol has a molecular weight of 202.05 g/mol, XLogP of 2.17, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-5,6-dimethylpyridin-3-ol is sourced from PubChem (CID 130119183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).