(2-bromo-5-methylphenyl)-(4-methyl-3-pyridinyl)methanol

C14H14BrNO — CID 115817855

IUPAC(2-bromo-5-methylphenyl)-(4-methyl-3-pyridinyl)methanol
SMILESCc1ccc(Br)c(C(O)c2cnccc2C)c1
InChIInChI=1S/C14H14BrNO/c1-9-3-4-13(15)11(7-9)14(17)12-8-16-6-5-10(12)2/h3-8,14,17H,1-2H3
InChIKeySGBAMVSTUXDYTG-UHFFFAOYSA-N
MW292.18 g/mol
LogP3.54
Rot. Bonds2

About (2-bromo-5-methylphenyl)-(4-methyl-3-pyridinyl)methanol

(2-bromo-5-methylphenyl)-(4-methyl-3-pyridinyl)methanol (PubChem CID 115817855) has the molecular formula C14H14BrNO and a molecular weight of 292.18 g/mol. Its IUPAC name is (2-bromo-5-methylphenyl)-(4-methyl-3-pyridinyl)methanol.

Molecular Properties

Compound Name(2-bromo-5-methylphenyl)-(4-methyl-3-pyridinyl)methanol
PubChem CID115817855
Molecular FormulaC14H14BrNO
Molecular Weight292.18 g/mol
Exact Mass291.03
IUPAC Name(2-bromo-5-methylphenyl)-(4-methyl-3-pyridinyl)methanol
SMILESCc1ccc(Br)c(C(O)c2cnccc2C)c1
InChIInChI=1S/C14H14BrNO/c1-9-3-4-13(15)11(7-9)14(17)12-8-16-6-5-10(12)2/h3-8,14,17H,1-2H3
InChIKeySGBAMVSTUXDYTG-UHFFFAOYSA-N
XLogP3.54
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.18
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2-bromo-5-methylphenyl)-isoquinolin-5-ylmethanol
CID 115795023
(3,5-dibromo-2-pyridinyl)-(4-methyl-3-pyridinyl)methanol
CID 113393932
(2-bromofuran-3-yl)-(4-methyl-3-pyridinyl)methanol
CID 106859365
1-(2-bromo-5-methylphenyl)-2-pyridin-4-ylpropan-1-ol
CID 81118052
(2-bromo-5-methylphenyl)-(2,5-dimethylthiophen-3-yl)methanol
CID 81111173
(3,4-dimethylphenyl)-(4-methyl-3-pyridinyl)methanol
CID 66274356
(5-bromo-2-fluorophenyl)-(2-bromo-5-methylphenyl)methanol
CID 115820779
(2,4-dibromophenyl)-(2,5-dimethylphenyl)methanol
CID 114019435
(4-bromothiophen-3-yl)-(2,5-dimethylphenyl)methanol
CID 79596472
(2,5-dimethoxyphenyl)-(4-methyl-3-pyridinyl)methanol
CID 66272656
1-(2-bromo-5-methylphenyl)-3-chloropropane-1,2-diol
CID 171863103
(4-methyl-3-pyridinyl)-pyridazin-4-ylmethanol
CID 105110785

Frequently Asked Questions

What is the IUPAC name of (2-bromo-5-methylphenyl)-(4-methyl-3-pyridinyl)methanol?
The IUPAC name of (2-bromo-5-methylphenyl)-(4-methyl-3-pyridinyl)methanol (CID 115817855) is (2-bromo-5-methylphenyl)-(4-methyl-3-pyridinyl)methanol.
What is the SMILES notation for (2-bromo-5-methylphenyl)-(4-methyl-3-pyridinyl)methanol?
The canonical SMILES for (2-bromo-5-methylphenyl)-(4-methyl-3-pyridinyl)methanol is Cc1ccc(Br)c(C(O)c2cnccc2C)c1.
What is the InChIKey of (2-bromo-5-methylphenyl)-(4-methyl-3-pyridinyl)methanol?
The InChIKey is SGBAMVSTUXDYTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14BrNO/c1-9-3-4-13(15)11(7-9)14(17)12-8-16-6-5-10(12)2/h3-8,14,17H,1-2H3.
What are the key properties of (2-bromo-5-methylphenyl)-(4-methyl-3-pyridinyl)methanol?
(2-bromo-5-methylphenyl)-(4-methyl-3-pyridinyl)methanol has a molecular weight of 292.18 g/mol, XLogP of 3.54, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-bromo-5-methylphenyl)-(4-methyl-3-pyridinyl)methanol is sourced from PubChem (CID 115817855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).