(4-bromophenyl)-pyrazin-2-ylmethanol

C11H9BrN2O — CID 63970462

IUPAC(4-bromophenyl)-pyrazin-2-ylmethanol
SMILESOC(c1ccc(Br)cc1)c1cnccn1
InChIInChI=1S/C11H9BrN2O/c12-9-3-1-8(2-4-9)11(15)10-7-13-5-6-14-10/h1-7,11,15H
InChIKeyTZMQKUAOLRGTSD-UHFFFAOYSA-N
MW265.11 g/mol
LogP2.32
Rot. Bonds2

About (4-bromophenyl)-pyrazin-2-ylmethanol

(4-bromophenyl)-pyrazin-2-ylmethanol (PubChem CID 63970462) has the molecular formula C11H9BrN2O and a molecular weight of 265.11 g/mol. Its IUPAC name is (4-bromophenyl)-pyrazin-2-ylmethanol.

Molecular Properties

Compound Name(4-bromophenyl)-pyrazin-2-ylmethanol
PubChem CID63970462
Molecular FormulaC11H9BrN2O
Molecular Weight265.11 g/mol
Exact Mass263.99
IUPAC Name(4-bromophenyl)-pyrazin-2-ylmethanol
SMILESOC(c1ccc(Br)cc1)c1cnccn1
InChIInChI=1S/C11H9BrN2O/c12-9-3-1-8(2-4-9)11(15)10-7-13-5-6-14-10/h1-7,11,15H
InChIKeyTZMQKUAOLRGTSD-UHFFFAOYSA-N
XLogP2.32
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.11
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(4-bromo-3-chlorophenyl)-pyrazin-2-ylmethanol
CID 115800192
(4-cyclopropylphenyl)-pyrazin-2-ylmethanol
CID 79980418
2-(4-bromophenyl)sulfanyl-1-pyrazin-2-ylethanol
CID 66054291
(4-methoxy-3-methylphenyl)-pyrazin-2-ylmethanol
CID 63969426
[4-bromo-2-(trifluoromethyl)phenyl]-pyrazin-2-ylmethanol
CID 63968386
(3-aminophenyl)-pyrazin-2-ylmethanol
CID 106695903
pyrazin-2-yl(quinolin-6-yl)methanol
CID 63969432
2-(4-bromophenyl)sulfanyl-1-pyrazin-2-ylethanamine
CID 66055692
pyrazin-2-yl(1,2-thiazol-5-yl)methanol
CID 131172108
(5-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-pyrazin-2-ylmethanol
CID 63970261
(3-ethoxyphenyl)-pyrazin-2-ylmethanol
CID 63969423
2-bromo-2-pyrazin-2-ylacetaldehyde
CID 87311321

Frequently Asked Questions

What is the IUPAC name of (4-bromophenyl)-pyrazin-2-ylmethanol?
The IUPAC name of (4-bromophenyl)-pyrazin-2-ylmethanol (CID 63970462) is (4-bromophenyl)-pyrazin-2-ylmethanol.
What is the SMILES notation for (4-bromophenyl)-pyrazin-2-ylmethanol?
The canonical SMILES for (4-bromophenyl)-pyrazin-2-ylmethanol is OC(c1ccc(Br)cc1)c1cnccn1.
What is the InChIKey of (4-bromophenyl)-pyrazin-2-ylmethanol?
The InChIKey is TZMQKUAOLRGTSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9BrN2O/c12-9-3-1-8(2-4-9)11(15)10-7-13-5-6-14-10/h1-7,11,15H.
What are the key properties of (4-bromophenyl)-pyrazin-2-ylmethanol?
(4-bromophenyl)-pyrazin-2-ylmethanol has a molecular weight of 265.11 g/mol, XLogP of 2.32, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-bromophenyl)-pyrazin-2-ylmethanol is sourced from PubChem (CID 63970462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).