2-(4-methoxyphenoxy)-N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)acetamide

C22H18N2O3S — CID 7917274

IUPAC2-(4-methoxyphenoxy)-N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)acetamide
SMILESCOc1ccc(OCC(=O)Nc2nc(-c3ccc4ccccc4c3)cs2)cc1
InChIInChI=1S/C22H18N2O3S/c1-26-18-8-10-19(11-9-18)27-13-21(25)24-22-23-20(14-28-22)17-7-6-15-4-2-3-5-16(15)12-17/h2-12,14H,13H2,1H3,(H,23,24,25)
InChIKeyXXSWWYUQZLFOFY-UHFFFAOYSA-N
MW390.46 g/mol
LogP4.99
Rot. Bonds6

About 2-(4-methoxyphenoxy)-N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)acetamide

2-(4-methoxyphenoxy)-N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)acetamide (PubChem CID 7917274) has the molecular formula C22H18N2O3S and a molecular weight of 390.46 g/mol. Its IUPAC name is 2-(4-methoxyphenoxy)-N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-(4-methoxyphenoxy)-N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)acetamide
PubChem CID7917274
Molecular FormulaC22H18N2O3S
Molecular Weight390.46 g/mol
Exact Mass390.10
IUPAC Name2-(4-methoxyphenoxy)-N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)acetamide
SMILESCOc1ccc(OCC(=O)Nc2nc(-c3ccc4ccccc4c3)cs2)cc1
InChIInChI=1S/C22H18N2O3S/c1-26-18-8-10-19(11-9-18)27-13-21(25)24-22-23-20(14-28-22)17-7-6-15-4-2-3-5-16(15)12-17/h2-12,14H,13H2,1H3,(H,23,24,25)
InChIKeyXXSWWYUQZLFOFY-UHFFFAOYSA-N
XLogP4.99
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.46
LogP ≤ 54.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenoxy)-N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)acetamide?
The IUPAC name of 2-(4-methoxyphenoxy)-N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)acetamide (CID 7917274) is 2-(4-methoxyphenoxy)-N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)acetamide.
What is the SMILES notation for 2-(4-methoxyphenoxy)-N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)acetamide?
The canonical SMILES for 2-(4-methoxyphenoxy)-N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)acetamide is COc1ccc(OCC(=O)Nc2nc(-c3ccc4ccccc4c3)cs2)cc1.
What is the InChIKey of 2-(4-methoxyphenoxy)-N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)acetamide?
The InChIKey is XXSWWYUQZLFOFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N2O3S/c1-26-18-8-10-19(11-9-18)27-13-21(25)24-22-23-20(14-28-22)17-7-6-15-4-2-3-5-16(15)12-17/h2-12,14H,13H2,1H3,(H,23,24,25).
What are the key properties of 2-(4-methoxyphenoxy)-N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)acetamide?
2-(4-methoxyphenoxy)-N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)acetamide has a molecular weight of 390.46 g/mol, XLogP of 4.99, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenoxy)-N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 7917274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).