1-(2-methoxy-3-pyridinyl)-2-(1,3-thiazol-2-yl)ethanol

C11H12N2O2S — CID 105115288

IUPAC1-(2-methoxy-3-pyridinyl)-2-(1,3-thiazol-2-yl)ethanol
SMILESCOc1ncccc1C(O)Cc1nccs1
InChIInChI=1S/C11H12N2O2S/c1-15-11-8(3-2-4-13-11)9(14)7-10-12-5-6-16-10/h2-6,9,14H,7H2,1H3
InChIKeyGIMXCMDFWWGUPA-UHFFFAOYSA-N
MW236.30 g/mol
LogP1.82
Rot. Bonds4

About 1-(2-methoxy-3-pyridinyl)-2-(1,3-thiazol-2-yl)ethanol

1-(2-methoxy-3-pyridinyl)-2-(1,3-thiazol-2-yl)ethanol (PubChem CID 105115288) has the molecular formula C11H12N2O2S and a molecular weight of 236.30 g/mol. Its IUPAC name is 1-(2-methoxy-3-pyridinyl)-2-(1,3-thiazol-2-yl)ethanol.

Molecular Properties

Compound Name1-(2-methoxy-3-pyridinyl)-2-(1,3-thiazol-2-yl)ethanol
PubChem CID105115288
Molecular FormulaC11H12N2O2S
Molecular Weight236.30 g/mol
Exact Mass236.06
IUPAC Name1-(2-methoxy-3-pyridinyl)-2-(1,3-thiazol-2-yl)ethanol
SMILESCOc1ncccc1C(O)Cc1nccs1
InChIInChI=1S/C11H12N2O2S/c1-15-11-8(3-2-4-13-11)9(14)7-10-12-5-6-16-10/h2-6,9,14H,7H2,1H3
InChIKeyGIMXCMDFWWGUPA-UHFFFAOYSA-N
XLogP1.82
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.30
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-(2-methoxy-3-pyridinyl)-2-(1,3-thiazol-2-yl)ethanol 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 1-(2-methoxy-3-pyridinyl)-2-(1,3-thiazol-2-yl)ethanol?
The IUPAC name of 1-(2-methoxy-3-pyridinyl)-2-(1,3-thiazol-2-yl)ethanol (CID 105115288) is 1-(2-methoxy-3-pyridinyl)-2-(1,3-thiazol-2-yl)ethanol.
What is the SMILES notation for 1-(2-methoxy-3-pyridinyl)-2-(1,3-thiazol-2-yl)ethanol?
The canonical SMILES for 1-(2-methoxy-3-pyridinyl)-2-(1,3-thiazol-2-yl)ethanol is COc1ncccc1C(O)Cc1nccs1.
What is the InChIKey of 1-(2-methoxy-3-pyridinyl)-2-(1,3-thiazol-2-yl)ethanol?
The InChIKey is GIMXCMDFWWGUPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O2S/c1-15-11-8(3-2-4-13-11)9(14)7-10-12-5-6-16-10/h2-6,9,14H,7H2,1H3.
What are the key properties of 1-(2-methoxy-3-pyridinyl)-2-(1,3-thiazol-2-yl)ethanol?
1-(2-methoxy-3-pyridinyl)-2-(1,3-thiazol-2-yl)ethanol has a molecular weight of 236.30 g/mol, XLogP of 1.82, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxy-3-pyridinyl)-2-(1,3-thiazol-2-yl)ethanol is sourced from PubChem (CID 105115288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).