[3-bromo-5-(difluoromethyl)-6-methoxy-2-pyridinyl]methanol

C8H8BrF2NO2 — CID 130068914

IUPAC[3-bromo-5-(difluoromethyl)-6-methoxy-2-pyridinyl]methanol
SMILESCOc1nc(CO)c(Br)cc1C(F)F
InChIInChI=1S/C8H8BrF2NO2/c1-14-8-4(7(10)11)2-5(9)6(3-13)12-8/h2,7,13H,3H2,1H3
InChIKeyAAWORLDRAXHZCF-UHFFFAOYSA-N
MW268.06 g/mol
LogP2.28
Rot. Bonds3

About [3-bromo-5-(difluoromethyl)-6-methoxy-2-pyridinyl]methanol

[3-bromo-5-(difluoromethyl)-6-methoxy-2-pyridinyl]methanol (PubChem CID 130068914) has the molecular formula C8H8BrF2NO2 and a molecular weight of 268.06 g/mol. Its IUPAC name is [3-bromo-5-(difluoromethyl)-6-methoxy-2-pyridinyl]methanol.

Molecular Properties

Compound Name[3-bromo-5-(difluoromethyl)-6-methoxy-2-pyridinyl]methanol
PubChem CID130068914
Molecular FormulaC8H8BrF2NO2
Molecular Weight268.06 g/mol
Exact Mass266.97
IUPAC Name[3-bromo-5-(difluoromethyl)-6-methoxy-2-pyridinyl]methanol
SMILESCOc1nc(CO)c(Br)cc1C(F)F
InChIInChI=1S/C8H8BrF2NO2/c1-14-8-4(7(10)11)2-5(9)6(3-13)12-8/h2,7,13H,3H2,1H3
InChIKeyAAWORLDRAXHZCF-UHFFFAOYSA-N
XLogP2.28
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.06
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [3-bromo-5-(difluoromethyl)-6-methoxy-2-pyridinyl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[5-bromo-3-(difluoromethyl)-6-methoxy-2-pyridinyl]methanol
CID 130068911
[5-(difluoromethyl)-6-methoxy-3-(trifluoromethyl)-2-pyridinyl]methanol
CID 133099748
2,3-dibromo-5-(difluoromethyl)-6-methoxypyridine
CID 119011483
3-bromo-5-(difluoromethyl)-6-methoxypyridine-2-carbonitrile
CID 130108665
3-bromo-5-(difluoromethyl)-6-methoxypyridine-2-sulfonamide
CID 130069062
5-bromo-3-(difluoromethyl)-2-fluoro-6-methoxypyridine
CID 130109364
[6-bromo-3-(difluoromethyl)-5-methoxy-2-pyridinyl]methanol
CID 119000833
[5-(difluoromethyl)-6-methoxy-3-methyl-2-pyridinyl]methanamine
CID 118831411
[6-bromo-4-(difluoromethyl)-3-methoxy-2-pyridinyl]methanol
CID 130068890
2-bromo-3-(bromomethyl)-5-(difluoromethyl)-6-methoxypyridine
CID 119011795
[6-(chloromethyl)-5-(difluoromethyl)-2-methoxy-3-pyridinyl]methanol
CID 118809943
2-[3-(aminomethyl)-5-(difluoromethyl)-6-methoxy-2-pyridinyl]acetic acid
CID 133085247

Frequently Asked Questions

What is the IUPAC name of [3-bromo-5-(difluoromethyl)-6-methoxy-2-pyridinyl]methanol?
The IUPAC name of [3-bromo-5-(difluoromethyl)-6-methoxy-2-pyridinyl]methanol (CID 130068914) is [3-bromo-5-(difluoromethyl)-6-methoxy-2-pyridinyl]methanol.
What is the SMILES notation for [3-bromo-5-(difluoromethyl)-6-methoxy-2-pyridinyl]methanol?
The canonical SMILES for [3-bromo-5-(difluoromethyl)-6-methoxy-2-pyridinyl]methanol is COc1nc(CO)c(Br)cc1C(F)F.
What is the InChIKey of [3-bromo-5-(difluoromethyl)-6-methoxy-2-pyridinyl]methanol?
The InChIKey is AAWORLDRAXHZCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8BrF2NO2/c1-14-8-4(7(10)11)2-5(9)6(3-13)12-8/h2,7,13H,3H2,1H3.
What are the key properties of [3-bromo-5-(difluoromethyl)-6-methoxy-2-pyridinyl]methanol?
[3-bromo-5-(difluoromethyl)-6-methoxy-2-pyridinyl]methanol has a molecular weight of 268.06 g/mol, XLogP of 2.28, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-bromo-5-(difluoromethyl)-6-methoxy-2-pyridinyl]methanol is sourced from PubChem (CID 130068914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).