[6-(4-bromophenyl)-3-pyridinyl]methanol

C12H10BrNO — CID 24729901

IUPAC[6-(4-bromophenyl)-3-pyridinyl]methanol
SMILESOCc1ccc(-c2ccc(Br)cc2)nc1
InChIInChI=1S/C12H10BrNO/c13-11-4-2-10(3-5-11)12-6-1-9(8-15)7-14-12/h1-7,15H,8H2
InChIKeyHROCZHYHAXTFMT-UHFFFAOYSA-N
MW264.12 g/mol
LogP3.00
Rot. Bonds2

About [6-(4-bromophenyl)-3-pyridinyl]methanol

[6-(4-bromophenyl)-3-pyridinyl]methanol (PubChem CID 24729901) has the molecular formula C12H10BrNO and a molecular weight of 264.12 g/mol. Its IUPAC name is [6-(4-bromophenyl)-3-pyridinyl]methanol.

Molecular Properties

Compound Name[6-(4-bromophenyl)-3-pyridinyl]methanol
PubChem CID24729901
Molecular FormulaC12H10BrNO
Molecular Weight264.12 g/mol
Exact Mass262.99
IUPAC Name[6-(4-bromophenyl)-3-pyridinyl]methanol
SMILESOCc1ccc(-c2ccc(Br)cc2)nc1
InChIInChI=1S/C12H10BrNO/c13-11-4-2-10(3-5-11)12-6-1-9(8-15)7-14-12/h1-7,15H,8H2
InChIKeyHROCZHYHAXTFMT-UHFFFAOYSA-N
XLogP3.00
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 ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [6-(4-bromophenyl)-3-pyridinyl]methanol?
The IUPAC name of [6-(4-bromophenyl)-3-pyridinyl]methanol (CID 24729901) is [6-(4-bromophenyl)-3-pyridinyl]methanol.
What is the SMILES notation for [6-(4-bromophenyl)-3-pyridinyl]methanol?
The canonical SMILES for [6-(4-bromophenyl)-3-pyridinyl]methanol is OCc1ccc(-c2ccc(Br)cc2)nc1.
What is the InChIKey of [6-(4-bromophenyl)-3-pyridinyl]methanol?
The InChIKey is HROCZHYHAXTFMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10BrNO/c13-11-4-2-10(3-5-11)12-6-1-9(8-15)7-14-12/h1-7,15H,8H2.
What are the key properties of [6-(4-bromophenyl)-3-pyridinyl]methanol?
[6-(4-bromophenyl)-3-pyridinyl]methanol has a molecular weight of 264.12 g/mol, XLogP of 3.00, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(4-bromophenyl)-3-pyridinyl]methanol is sourced from PubChem (CID 24729901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).