2-(2-phenylphenoxy)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)acetamide

C22H17N3O2S — CID 4857465

IUPAC2-(2-phenylphenoxy)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)acetamide
SMILESO=C(COc1ccccc1-c1ccccc1)Nc1nc(-c2ccccn2)cs1
InChIInChI=1S/C22H17N3O2S/c26-21(25-22-24-19(15-28-22)18-11-6-7-13-23-18)14-27-20-12-5-4-10-17(20)16-8-2-1-3-9-16/h1-13,15H,14H2,(H,24,25,26)
InChIKeyMNFPZZPOWGRIIO-UHFFFAOYSA-N
MW387.46 g/mol
LogP4.89
Rot. Bonds6

About 2-(2-phenylphenoxy)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)acetamide

2-(2-phenylphenoxy)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)acetamide (PubChem CID 4857465) has the molecular formula C22H17N3O2S and a molecular weight of 387.46 g/mol. Its IUPAC name is 2-(2-phenylphenoxy)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-(2-phenylphenoxy)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)acetamide
PubChem CID4857465
Molecular FormulaC22H17N3O2S
Molecular Weight387.46 g/mol
Exact Mass387.10
IUPAC Name2-(2-phenylphenoxy)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)acetamide
SMILESO=C(COc1ccccc1-c1ccccc1)Nc1nc(-c2ccccn2)cs1
InChIInChI=1S/C22H17N3O2S/c26-21(25-22-24-19(15-28-22)18-11-6-7-13-23-18)14-27-20-12-5-4-10-17(20)16-8-2-1-3-9-16/h1-13,15H,14H2,(H,24,25,26)
InChIKeyMNFPZZPOWGRIIO-UHFFFAOYSA-N
XLogP4.89
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.46
LogP ≤ 54.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(2-phenylphenoxy)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)acetamide?
The IUPAC name of 2-(2-phenylphenoxy)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)acetamide (CID 4857465) is 2-(2-phenylphenoxy)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)acetamide.
What is the SMILES notation for 2-(2-phenylphenoxy)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)acetamide?
The canonical SMILES for 2-(2-phenylphenoxy)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)acetamide is O=C(COc1ccccc1-c1ccccc1)Nc1nc(-c2ccccn2)cs1.
What is the InChIKey of 2-(2-phenylphenoxy)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)acetamide?
The InChIKey is MNFPZZPOWGRIIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17N3O2S/c26-21(25-22-24-19(15-28-22)18-11-6-7-13-23-18)14-27-20-12-5-4-10-17(20)16-8-2-1-3-9-16/h1-13,15H,14H2,(H,24,25,26).
What are the key properties of 2-(2-phenylphenoxy)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)acetamide?
2-(2-phenylphenoxy)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)acetamide has a molecular weight of 387.46 g/mol, XLogP of 4.89, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-phenylphenoxy)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 4857465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).