[2-(2,6-dimethoxyphenoxy)-4,6-dimethyl-3-pyridinyl]methanol

C16H19NO4 — CID 61255443

IUPAC[2-(2,6-dimethoxyphenoxy)-4,6-dimethyl-3-pyridinyl]methanol
SMILESCOc1cccc(OC)c1Oc1nc(C)cc(C)c1CO
InChIInChI=1S/C16H19NO4/c1-10-8-11(2)17-16(12(10)9-18)21-15-13(19-3)6-5-7-14(15)20-4/h5-8,18H,9H2,1-4H3
InChIKeySZQUPEVMNOEDPG-UHFFFAOYSA-N
MW289.33 g/mol
LogP3.00
Rot. Bonds5

About [2-(2,6-dimethoxyphenoxy)-4,6-dimethyl-3-pyridinyl]methanol

[2-(2,6-dimethoxyphenoxy)-4,6-dimethyl-3-pyridinyl]methanol (PubChem CID 61255443) has the molecular formula C16H19NO4 and a molecular weight of 289.33 g/mol. Its IUPAC name is [2-(2,6-dimethoxyphenoxy)-4,6-dimethyl-3-pyridinyl]methanol.

Molecular Properties

Compound Name[2-(2,6-dimethoxyphenoxy)-4,6-dimethyl-3-pyridinyl]methanol
PubChem CID61255443
Molecular FormulaC16H19NO4
Molecular Weight289.33 g/mol
Exact Mass289.13
IUPAC Name[2-(2,6-dimethoxyphenoxy)-4,6-dimethyl-3-pyridinyl]methanol
SMILESCOc1cccc(OC)c1Oc1nc(C)cc(C)c1CO
InChIInChI=1S/C16H19NO4/c1-10-8-11(2)17-16(12(10)9-18)21-15-13(19-3)6-5-7-14(15)20-4/h5-8,18H,9H2,1-4H3
InChIKeySZQUPEVMNOEDPG-UHFFFAOYSA-N
XLogP3.00
TPSA60.81 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.33
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze [2-(2,6-dimethoxyphenoxy)-4,6-dimethyl-3-pyridinyl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [2-(2,6-dimethoxyphenoxy)-4,6-dimethyl-3-pyridinyl]methanol?
The IUPAC name of [2-(2,6-dimethoxyphenoxy)-4,6-dimethyl-3-pyridinyl]methanol (CID 61255443) is [2-(2,6-dimethoxyphenoxy)-4,6-dimethyl-3-pyridinyl]methanol.
What is the SMILES notation for [2-(2,6-dimethoxyphenoxy)-4,6-dimethyl-3-pyridinyl]methanol?
The canonical SMILES for [2-(2,6-dimethoxyphenoxy)-4,6-dimethyl-3-pyridinyl]methanol is COc1cccc(OC)c1Oc1nc(C)cc(C)c1CO.
What is the InChIKey of [2-(2,6-dimethoxyphenoxy)-4,6-dimethyl-3-pyridinyl]methanol?
The InChIKey is SZQUPEVMNOEDPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO4/c1-10-8-11(2)17-16(12(10)9-18)21-15-13(19-3)6-5-7-14(15)20-4/h5-8,18H,9H2,1-4H3.
What are the key properties of [2-(2,6-dimethoxyphenoxy)-4,6-dimethyl-3-pyridinyl]methanol?
[2-(2,6-dimethoxyphenoxy)-4,6-dimethyl-3-pyridinyl]methanol has a molecular weight of 289.33 g/mol, XLogP of 3.00, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2,6-dimethoxyphenoxy)-4,6-dimethyl-3-pyridinyl]methanol is sourced from PubChem (CID 61255443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).