2-[1-methoxy-1-[2-methyl-5-(naphthalen-2-ylmethoxy)phenyl]ethyl]-1,3-thiazole

C24H23NO2S — CID 15050015

IUPAC2-[1-methoxy-1-[2-methyl-5-(naphthalen-2-ylmethoxy)phenyl]ethyl]-1,3-thiazole
SMILESCOC(C)(c1nccs1)c1cc(OCc2ccc3ccccc3c2)ccc1C
InChIInChI=1S/C24H23NO2S/c1-17-8-11-21(15-22(17)24(2,26-3)23-25-12-13-28-23)27-16-18-9-10-19-6-4-5-7-20(19)14-18/h4-15H,16H2,1-3H3
InChIKeyMCCYRRSHNCJVAD-UHFFFAOYSA-N
MW389.52 g/mol
LogP6.09
Rot. Bonds6

About 2-[1-methoxy-1-[2-methyl-5-(naphthalen-2-ylmethoxy)phenyl]ethyl]-1,3-thiazole

2-[1-methoxy-1-[2-methyl-5-(naphthalen-2-ylmethoxy)phenyl]ethyl]-1,3-thiazole (PubChem CID 15050015) has the molecular formula C24H23NO2S and a molecular weight of 389.52 g/mol. Its IUPAC name is 2-[1-methoxy-1-[2-methyl-5-(naphthalen-2-ylmethoxy)phenyl]ethyl]-1,3-thiazole.

Molecular Properties

Compound Name2-[1-methoxy-1-[2-methyl-5-(naphthalen-2-ylmethoxy)phenyl]ethyl]-1,3-thiazole
PubChem CID15050015
Molecular FormulaC24H23NO2S
Molecular Weight389.52 g/mol
Exact Mass389.14
IUPAC Name2-[1-methoxy-1-[2-methyl-5-(naphthalen-2-ylmethoxy)phenyl]ethyl]-1,3-thiazole
SMILESCOC(C)(c1nccs1)c1cc(OCc2ccc3ccccc3c2)ccc1C
InChIInChI=1S/C24H23NO2S/c1-17-8-11-21(15-22(17)24(2,26-3)23-25-12-13-28-23)27-16-18-9-10-19-6-4-5-7-20(19)14-18/h4-15H,16H2,1-3H3
InChIKeyMCCYRRSHNCJVAD-UHFFFAOYSA-N
XLogP6.09
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500389.52
LogP ≤ 56.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-[1-methoxy-1-[2-methyl-5-(naphthalen-2-ylmethoxy)phenyl]ethyl]-1,3-thiazole 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-[1-methoxy-1-[2-methyl-5-(naphthalen-2-ylmethoxy)phenyl]ethyl]-1,3-thiazole?
The IUPAC name of 2-[1-methoxy-1-[2-methyl-5-(naphthalen-2-ylmethoxy)phenyl]ethyl]-1,3-thiazole (CID 15050015) is 2-[1-methoxy-1-[2-methyl-5-(naphthalen-2-ylmethoxy)phenyl]ethyl]-1,3-thiazole.
What is the SMILES notation for 2-[1-methoxy-1-[2-methyl-5-(naphthalen-2-ylmethoxy)phenyl]ethyl]-1,3-thiazole?
The canonical SMILES for 2-[1-methoxy-1-[2-methyl-5-(naphthalen-2-ylmethoxy)phenyl]ethyl]-1,3-thiazole is COC(C)(c1nccs1)c1cc(OCc2ccc3ccccc3c2)ccc1C.
What is the InChIKey of 2-[1-methoxy-1-[2-methyl-5-(naphthalen-2-ylmethoxy)phenyl]ethyl]-1,3-thiazole?
The InChIKey is MCCYRRSHNCJVAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23NO2S/c1-17-8-11-21(15-22(17)24(2,26-3)23-25-12-13-28-23)27-16-18-9-10-19-6-4-5-7-20(19)14-18/h4-15H,16H2,1-3H3.
What are the key properties of 2-[1-methoxy-1-[2-methyl-5-(naphthalen-2-ylmethoxy)phenyl]ethyl]-1,3-thiazole?
2-[1-methoxy-1-[2-methyl-5-(naphthalen-2-ylmethoxy)phenyl]ethyl]-1,3-thiazole has a molecular weight of 389.52 g/mol, XLogP of 6.09, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-methoxy-1-[2-methyl-5-(naphthalen-2-ylmethoxy)phenyl]ethyl]-1,3-thiazole is sourced from PubChem (CID 15050015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).