2-[4-[(4-methoxy-6-methyl-2-pyridinyl)methoxy]phenyl]ethanol

C16H19NO3 — CID 103887327

IUPAC2-[4-[(4-methoxy-6-methyl-2-pyridinyl)methoxy]phenyl]ethanol
SMILESCOc1cc(C)nc(COc2ccc(CCO)cc2)c1
InChIInChI=1S/C16H19NO3/c1-12-9-16(19-2)10-14(17-12)11-20-15-5-3-13(4-6-15)7-8-18/h3-6,9-10,18H,7-8,11H2,1-2H3
InChIKeyKOKCJUJREFKKSF-UHFFFAOYSA-N
MW273.33 g/mol
LogP2.51
Rot. Bonds6

About 2-[4-[(4-methoxy-6-methyl-2-pyridinyl)methoxy]phenyl]ethanol

2-[4-[(4-methoxy-6-methyl-2-pyridinyl)methoxy]phenyl]ethanol (PubChem CID 103887327) has the molecular formula C16H19NO3 and a molecular weight of 273.33 g/mol. Its IUPAC name is 2-[4-[(4-methoxy-6-methyl-2-pyridinyl)methoxy]phenyl]ethanol.

Molecular Properties

Compound Name2-[4-[(4-methoxy-6-methyl-2-pyridinyl)methoxy]phenyl]ethanol
PubChem CID103887327
Molecular FormulaC16H19NO3
Molecular Weight273.33 g/mol
Exact Mass273.14
IUPAC Name2-[4-[(4-methoxy-6-methyl-2-pyridinyl)methoxy]phenyl]ethanol
SMILESCOc1cc(C)nc(COc2ccc(CCO)cc2)c1
InChIInChI=1S/C16H19NO3/c1-12-9-16(19-2)10-14(17-12)11-20-15-5-3-13(4-6-15)7-8-18/h3-6,9-10,18H,7-8,11H2,1-2H3
InChIKeyKOKCJUJREFKKSF-UHFFFAOYSA-N
XLogP2.51
TPSA51.58 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.33
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[4-[(4-methoxy-6-methyl-2-pyridinyl)methoxy]phenyl]ethanol?
The IUPAC name of 2-[4-[(4-methoxy-6-methyl-2-pyridinyl)methoxy]phenyl]ethanol (CID 103887327) is 2-[4-[(4-methoxy-6-methyl-2-pyridinyl)methoxy]phenyl]ethanol.
What is the SMILES notation for 2-[4-[(4-methoxy-6-methyl-2-pyridinyl)methoxy]phenyl]ethanol?
The canonical SMILES for 2-[4-[(4-methoxy-6-methyl-2-pyridinyl)methoxy]phenyl]ethanol is COc1cc(C)nc(COc2ccc(CCO)cc2)c1.
What is the InChIKey of 2-[4-[(4-methoxy-6-methyl-2-pyridinyl)methoxy]phenyl]ethanol?
The InChIKey is KOKCJUJREFKKSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO3/c1-12-9-16(19-2)10-14(17-12)11-20-15-5-3-13(4-6-15)7-8-18/h3-6,9-10,18H,7-8,11H2,1-2H3.
What are the key properties of 2-[4-[(4-methoxy-6-methyl-2-pyridinyl)methoxy]phenyl]ethanol?
2-[4-[(4-methoxy-6-methyl-2-pyridinyl)methoxy]phenyl]ethanol has a molecular weight of 273.33 g/mol, XLogP of 2.51, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(4-methoxy-6-methyl-2-pyridinyl)methoxy]phenyl]ethanol is sourced from PubChem (CID 103887327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).