1-(5-bromo-2-pyridinyl)ethanol

C7H8BrNO — CID 42614288

IUPAC1-(5-bromo-2-pyridinyl)ethanol
SMILESCC(O)c1ccc(Br)cn1
InChIInChI=1S/C7H8BrNO/c1-5(10)7-3-2-6(8)4-9-7/h2-5,10H,1H3
InChIKeyMFQDJRTUQSZLOZ-UHFFFAOYSA-N
MW202.05 g/mol
LogP1.90
Rot. Bonds1

About 1-(5-bromo-2-pyridinyl)ethanol

1-(5-bromo-2-pyridinyl)ethanol (PubChem CID 42614288) has the molecular formula C7H8BrNO and a molecular weight of 202.05 g/mol. Its IUPAC name is 1-(5-bromo-2-pyridinyl)ethanol.

Molecular Properties

Compound Name1-(5-bromo-2-pyridinyl)ethanol
PubChem CID42614288
Molecular FormulaC7H8BrNO
Molecular Weight202.05 g/mol
Exact Mass200.98
IUPAC Name1-(5-bromo-2-pyridinyl)ethanol
SMILESCC(O)c1ccc(Br)cn1
InChIInChI=1S/C7H8BrNO/c1-5(10)7-3-2-6(8)4-9-7/h2-5,10H,1H3
InChIKeyMFQDJRTUQSZLOZ-UHFFFAOYSA-N
XLogP1.90
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.05
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[(1S)-1-(5-bromo-2-pyridinyl)ethyl]azanium chloride
CID 89251860
2-(4-bromophenyl)-1-(5-bromo-2-pyridinyl)ethanol
CID 113393940
1-[5-[4-(4-bromophenyl)piperazin-1-yl]-2-pyridinyl]ethanol
CID 137407156
(1S)-1-(5-bromo-2-pyridinyl)-N-methylethanamine
CID 130641134
1-(5-bromo-2-pyridinyl)-2-methylpentan-1-ol
CID 107892788
(1R)-1-(5-chloro-2-pyridinyl)ethanol
CID 75356463
[6-(1-hydroxyethyl)-3-pyridinyl]boronic acid
CID 67969224
(5-bromo-2-pyridinyl)-phenylmethanol
CID 10587663
3-bromo-1-(5-bromo-2-pyridinyl)propane-1,2-diol
CID 171861041
(5-bromo-2-pyridinyl)-pyrimidin-2-ylmethanol
CID 171846031
1-[5-(5-bromo-2-methylphenoxy)-2-pyridinyl]ethanol
CID 107284882
(4-bromo-1-propan-2-ylpyrazol-5-yl)-(5-bromo-2-pyridinyl)methanol
CID 114638199

Frequently Asked Questions

What is the IUPAC name of 1-(5-bromo-2-pyridinyl)ethanol?
The IUPAC name of 1-(5-bromo-2-pyridinyl)ethanol (CID 42614288) is 1-(5-bromo-2-pyridinyl)ethanol.
What is the SMILES notation for 1-(5-bromo-2-pyridinyl)ethanol?
The canonical SMILES for 1-(5-bromo-2-pyridinyl)ethanol is CC(O)c1ccc(Br)cn1.
What is the InChIKey of 1-(5-bromo-2-pyridinyl)ethanol?
The InChIKey is MFQDJRTUQSZLOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8BrNO/c1-5(10)7-3-2-6(8)4-9-7/h2-5,10H,1H3.
What are the key properties of 1-(5-bromo-2-pyridinyl)ethanol?
1-(5-bromo-2-pyridinyl)ethanol has a molecular weight of 202.05 g/mol, XLogP of 1.90, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-bromo-2-pyridinyl)ethanol is sourced from PubChem (CID 42614288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).