[5-chloro-6-(2,3,5-trimethylphenoxy)-3-pyridinyl]methanol

C15H16ClNO2 — CID 61256314

IUPAC[5-chloro-6-(2,3,5-trimethylphenoxy)-3-pyridinyl]methanol
SMILESCc1cc(C)c(C)c(Oc2ncc(CO)cc2Cl)c1
InChIInChI=1S/C15H16ClNO2/c1-9-4-10(2)11(3)14(5-9)19-15-13(16)6-12(8-18)7-17-15/h4-7,18H,8H2,1-3H3
InChIKeyZZQJFGKLLJQPLK-UHFFFAOYSA-N
MW277.75 g/mol
LogP3.94
Rot. Bonds3

About [5-chloro-6-(2,3,5-trimethylphenoxy)-3-pyridinyl]methanol

[5-chloro-6-(2,3,5-trimethylphenoxy)-3-pyridinyl]methanol (PubChem CID 61256314) has the molecular formula C15H16ClNO2 and a molecular weight of 277.75 g/mol. Its IUPAC name is [5-chloro-6-(2,3,5-trimethylphenoxy)-3-pyridinyl]methanol.

Molecular Properties

Compound Name[5-chloro-6-(2,3,5-trimethylphenoxy)-3-pyridinyl]methanol
PubChem CID61256314
Molecular FormulaC15H16ClNO2
Molecular Weight277.75 g/mol
Exact Mass277.09
IUPAC Name[5-chloro-6-(2,3,5-trimethylphenoxy)-3-pyridinyl]methanol
SMILESCc1cc(C)c(C)c(Oc2ncc(CO)cc2Cl)c1
InChIInChI=1S/C15H16ClNO2/c1-9-4-10(2)11(3)14(5-9)19-15-13(16)6-12(8-18)7-17-15/h4-7,18H,8H2,1-3H3
InChIKeyZZQJFGKLLJQPLK-UHFFFAOYSA-N
XLogP3.94
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.75
LogP ≤ 53.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[5-chloro-6-(2-fluoro-5-methylphenoxy)-3-pyridinyl]methanol
CID 64855240
5-chloro-6-(2,3,5-trimethylphenoxy)pyridin-3-amine
CID 114046382
[6-(4-bromo-3,5-dimethylphenoxy)-5-chloro-3-pyridinyl]methanol
CID 107725609
[5-chloro-6-(2,4-dibromophenoxy)-3-pyridinyl]methanol
CID 64721323
[5-chloro-6-(3-fluoro-4-methylphenoxy)-3-pyridinyl]methanol
CID 107170106
[6-(2,3-dichlorophenoxy)-5-methyl-3-pyridinyl]methanol
CID 80629406
[6-(4-bromo-2-fluorophenoxy)-5-chloro-3-pyridinyl]methanol
CID 61257547
[5-chloro-6-(3-methylsulfonylphenoxy)-3-pyridinyl]methanol
CID 61256942
[3-fluoro-2-(2,3,5-trimethylphenoxy)-4-pyridinyl]methanol
CID 105383279
[5-chloro-6-(3-iodophenoxy)-3-pyridinyl]methanol
CID 61255474
5-(bromomethyl)-2-(2,3,5-trimethylphenoxy)pyridine
CID 107087446
(6-chloro-5-methoxy-3-pyridinyl)methanol
CID 59297074

Frequently Asked Questions

What is the IUPAC name of [5-chloro-6-(2,3,5-trimethylphenoxy)-3-pyridinyl]methanol?
The IUPAC name of [5-chloro-6-(2,3,5-trimethylphenoxy)-3-pyridinyl]methanol (CID 61256314) is [5-chloro-6-(2,3,5-trimethylphenoxy)-3-pyridinyl]methanol.
What is the SMILES notation for [5-chloro-6-(2,3,5-trimethylphenoxy)-3-pyridinyl]methanol?
The canonical SMILES for [5-chloro-6-(2,3,5-trimethylphenoxy)-3-pyridinyl]methanol is Cc1cc(C)c(C)c(Oc2ncc(CO)cc2Cl)c1.
What is the InChIKey of [5-chloro-6-(2,3,5-trimethylphenoxy)-3-pyridinyl]methanol?
The InChIKey is ZZQJFGKLLJQPLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16ClNO2/c1-9-4-10(2)11(3)14(5-9)19-15-13(16)6-12(8-18)7-17-15/h4-7,18H,8H2,1-3H3.
What are the key properties of [5-chloro-6-(2,3,5-trimethylphenoxy)-3-pyridinyl]methanol?
[5-chloro-6-(2,3,5-trimethylphenoxy)-3-pyridinyl]methanol has a molecular weight of 277.75 g/mol, XLogP of 3.94, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5-chloro-6-(2,3,5-trimethylphenoxy)-3-pyridinyl]methanol is sourced from PubChem (CID 61256314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).