[6-[(3-bromophenyl)methoxy]-2-methyl-3-pyridinyl]methanol

C14H14BrNO2 — CID 82832022

IUPAC[6-[(3-bromophenyl)methoxy]-2-methyl-3-pyridinyl]methanol
SMILESCc1nc(OCc2cccc(Br)c2)ccc1CO
InChIInChI=1S/C14H14BrNO2/c1-10-12(8-17)5-6-14(16-10)18-9-11-3-2-4-13(15)7-11/h2-7,17H,8-9H2,1H3
InChIKeyPLBQURDHUGMONE-UHFFFAOYSA-N
MW308.18 g/mol
LogP3.22
Rot. Bonds4

About [6-[(3-bromophenyl)methoxy]-2-methyl-3-pyridinyl]methanol

[6-[(3-bromophenyl)methoxy]-2-methyl-3-pyridinyl]methanol (PubChem CID 82832022) has the molecular formula C14H14BrNO2 and a molecular weight of 308.18 g/mol. Its IUPAC name is [6-[(3-bromophenyl)methoxy]-2-methyl-3-pyridinyl]methanol.

Molecular Properties

Compound Name[6-[(3-bromophenyl)methoxy]-2-methyl-3-pyridinyl]methanol
PubChem CID82832022
Molecular FormulaC14H14BrNO2
Molecular Weight308.18 g/mol
Exact Mass307.02
IUPAC Name[6-[(3-bromophenyl)methoxy]-2-methyl-3-pyridinyl]methanol
SMILESCc1nc(OCc2cccc(Br)c2)ccc1CO
InChIInChI=1S/C14H14BrNO2/c1-10-12(8-17)5-6-14(16-10)18-9-11-3-2-4-13(15)7-11/h2-7,17H,8-9H2,1H3
InChIKeyPLBQURDHUGMONE-UHFFFAOYSA-N
XLogP3.22
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.18
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-[(3-bromophenyl)methoxy]-3-(chloromethyl)-2-methylpyridine
CID 82831791
2-(2-methyl-6-phenylmethoxy-3-pyridinyl)ethanol
CID 102546176
[3-[(3-bromophenyl)methoxy]-6-methyl-2-pyridinyl]methanol
CID 79158554
6-[(3-bromophenyl)methoxy]-2-methoxypyridin-3-amine
CID 82827567
(2-methyl-6-phenylmethoxy-3-pyridinyl)methanamine
CID 79885210
2-[(3-bromophenyl)methoxy]-3-chloro-5,6-dimethylpyrazine
CID 82824481
N-[[6-[(4-bromophenyl)methoxy]-2-methyl-3-pyridinyl]methyl]ethanamine
CID 82832289
6-[(3-bromophenyl)methoxy]-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine
CID 82804375
2-[(3-bromophenyl)methoxy]-5-methylpyridin-4-amine
CID 83270095
4-[(3-bromophenyl)methoxy]-N-ethyl-6-methylpyrimidin-2-amine
CID 82826004
[2-[(3-bromophenyl)methoxy]naphthalen-1-yl]methanol
CID 43505743
4-[(3-bromophenyl)methoxy]-N-propylpyrimidin-2-amine
CID 82825921

Frequently Asked Questions

What is the IUPAC name of [6-[(3-bromophenyl)methoxy]-2-methyl-3-pyridinyl]methanol?
The IUPAC name of [6-[(3-bromophenyl)methoxy]-2-methyl-3-pyridinyl]methanol (CID 82832022) is [6-[(3-bromophenyl)methoxy]-2-methyl-3-pyridinyl]methanol.
What is the SMILES notation for [6-[(3-bromophenyl)methoxy]-2-methyl-3-pyridinyl]methanol?
The canonical SMILES for [6-[(3-bromophenyl)methoxy]-2-methyl-3-pyridinyl]methanol is Cc1nc(OCc2cccc(Br)c2)ccc1CO.
What is the InChIKey of [6-[(3-bromophenyl)methoxy]-2-methyl-3-pyridinyl]methanol?
The InChIKey is PLBQURDHUGMONE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14BrNO2/c1-10-12(8-17)5-6-14(16-10)18-9-11-3-2-4-13(15)7-11/h2-7,17H,8-9H2,1H3.
What are the key properties of [6-[(3-bromophenyl)methoxy]-2-methyl-3-pyridinyl]methanol?
[6-[(3-bromophenyl)methoxy]-2-methyl-3-pyridinyl]methanol has a molecular weight of 308.18 g/mol, XLogP of 3.22, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[(3-bromophenyl)methoxy]-2-methyl-3-pyridinyl]methanol is sourced from PubChem (CID 82832022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).