2-(3-acetylphenoxy)-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]acetamide

C23H23N3O4S — CID 24573065

IUPAC2-(3-acetylphenoxy)-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]acetamide
SMILESCC(=O)c1cccc(OCC(=O)Nc2ccc(-c3csc(N4CCOCC4)n3)cc2)c1
InChIInChI=1S/C23H23N3O4S/c1-16(27)18-3-2-4-20(13-18)30-14-22(28)24-19-7-5-17(6-8-19)21-15-31-23(25-21)26-9-11-29-12-10-26/h2-8,13,15H,9-12,14H2,1H3,(H,24,28)
InChIKeyDDSZUTWUNRBKGS-UHFFFAOYSA-N
MW437.52 g/mol
LogP3.87
Rot. Bonds7

About 2-(3-acetylphenoxy)-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]acetamide

2-(3-acetylphenoxy)-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]acetamide (PubChem CID 24573065) has the molecular formula C23H23N3O4S and a molecular weight of 437.52 g/mol. Its IUPAC name is 2-(3-acetylphenoxy)-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]acetamide.

Molecular Properties

Compound Name2-(3-acetylphenoxy)-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]acetamide
PubChem CID24573065
Molecular FormulaC23H23N3O4S
Molecular Weight437.52 g/mol
Exact Mass437.14
IUPAC Name2-(3-acetylphenoxy)-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]acetamide
SMILESCC(=O)c1cccc(OCC(=O)Nc2ccc(-c3csc(N4CCOCC4)n3)cc2)c1
InChIInChI=1S/C23H23N3O4S/c1-16(27)18-3-2-4-20(13-18)30-14-22(28)24-19-7-5-17(6-8-19)21-15-31-23(25-21)26-9-11-29-12-10-26/h2-8,13,15H,9-12,14H2,1H3,(H,24,28)
InChIKeyDDSZUTWUNRBKGS-UHFFFAOYSA-N
XLogP3.87
TPSA80.76 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500437.52
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-[4-(4-acetamidophenyl)-1,3-thiazol-2-yl]-2-(3-acetylphenoxy)acetamide
CID 4826568
2-(3-acetylphenoxy)-N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]acetamide
CID 7937389
2-(3-acetylphenoxy)-N-(4-methylphenyl)acetamide
CID 2616941
N-(4-acetamidophenyl)-2-(3-acetylphenoxy)acetamide
CID 2627260
N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]-2-(2-oxo-1-pyridinyl)acetamide
CID 17493632
6-[[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]carbamoyl]pyridine-2-carboxylic acid
CID 167811855
3-[4-(dimethylamino)phenyl]-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]propanamide
CID 18272653
3-fluoro-4-methoxy-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]benzamide
CID 41248355
2-(3-acetylphenoxy)-N-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]acetamide
CID 2671831
2-chloro-2-fluoro-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]acetamide
CID 166427762
2-(4-chlorophenoxy)-N-[3-(2-piperidin-1-yl-1,3-thiazol-4-yl)phenyl]acetamide
CID 1195308
2-(dimethylamino)-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]pyridine-3-carboxamide
CID 38936617

Frequently Asked Questions

What is the IUPAC name of 2-(3-acetylphenoxy)-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]acetamide?
The IUPAC name of 2-(3-acetylphenoxy)-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]acetamide (CID 24573065) is 2-(3-acetylphenoxy)-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]acetamide.
What is the SMILES notation for 2-(3-acetylphenoxy)-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]acetamide?
The canonical SMILES for 2-(3-acetylphenoxy)-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]acetamide is CC(=O)c1cccc(OCC(=O)Nc2ccc(-c3csc(N4CCOCC4)n3)cc2)c1.
What is the InChIKey of 2-(3-acetylphenoxy)-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]acetamide?
The InChIKey is DDSZUTWUNRBKGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O4S/c1-16(27)18-3-2-4-20(13-18)30-14-22(28)24-19-7-5-17(6-8-19)21-15-31-23(25-21)26-9-11-29-12-10-26/h2-8,13,15H,9-12,14H2,1H3,(H,24,28).
What are the key properties of 2-(3-acetylphenoxy)-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]acetamide?
2-(3-acetylphenoxy)-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]acetamide has a molecular weight of 437.52 g/mol, XLogP of 3.87, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-acetylphenoxy)-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]acetamide is sourced from PubChem (CID 24573065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).