5-fluoro-2-methoxy-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]benzamide

C21H20FN3O3S — CID 26012155

IUPAC5-fluoro-2-methoxy-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]benzamide
SMILESCOc1ccc(F)cc1C(=O)Nc1ccc(-c2csc(N3CCOCC3)n2)cc1
InChIInChI=1S/C21H20FN3O3S/c1-27-19-7-4-15(22)12-17(19)20(26)23-16-5-2-14(3-6-16)18-13-29-21(24-18)25-8-10-28-11-9-25/h2-7,12-13H,8-11H2,1H3,(H,23,26)
InChIKeyUZQLHEHLMGRFBR-UHFFFAOYSA-N
MW413.47 g/mol
LogP4.05
Rot. Bonds5

About 5-fluoro-2-methoxy-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]benzamide

5-fluoro-2-methoxy-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]benzamide (PubChem CID 26012155) has the molecular formula C21H20FN3O3S and a molecular weight of 413.47 g/mol. Its IUPAC name is 5-fluoro-2-methoxy-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]benzamide.

Molecular Properties

Compound Name5-fluoro-2-methoxy-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]benzamide
PubChem CID26012155
Molecular FormulaC21H20FN3O3S
Molecular Weight413.47 g/mol
Exact Mass413.12
IUPAC Name5-fluoro-2-methoxy-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]benzamide
SMILESCOc1ccc(F)cc1C(=O)Nc1ccc(-c2csc(N3CCOCC3)n2)cc1
InChIInChI=1S/C21H20FN3O3S/c1-27-19-7-4-15(22)12-17(19)20(26)23-16-5-2-14(3-6-16)18-13-29-21(24-18)25-8-10-28-11-9-25/h2-7,12-13H,8-11H2,1H3,(H,23,26)
InChIKeyUZQLHEHLMGRFBR-UHFFFAOYSA-N
XLogP4.05
TPSA63.69 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500413.47
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

3-fluoro-4-methoxy-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]benzamide
CID 41248355
2-(dimethylamino)-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]pyridine-3-carboxamide
CID 38936617
6-[[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]carbamoyl]pyridine-2-carboxylic acid
CID 167811855
2-chloro-2-fluoro-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]acetamide
CID 166427762
(3,4-dimethoxyphenyl)-[4-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]piperazin-1-yl]methanone
CID 133371022
N-(4-acetamidophenyl)-5-fluoro-2-methoxybenzamide
CID 31063829
N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]-1H-indazole-3-carboxamide
CID 41452060
2-methyl-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]-1H-indole-3-carboxamide
CID 24629987
1-(5,6-dihydro-4H-pyrrolo[2,1-e]pyrazol-2-yl)-3-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]urea
CID 167887337
2-methoxy-N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-5-morpholin-4-ylsulfonylbenzamide
CID 27845372
2-(3-acetylphenoxy)-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]acetamide
CID 24573065
2,4,5-trimethoxy-N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)benzamide
CID 17493258

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2-methoxy-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]benzamide?
The IUPAC name of 5-fluoro-2-methoxy-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]benzamide (CID 26012155) is 5-fluoro-2-methoxy-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]benzamide.
What is the SMILES notation for 5-fluoro-2-methoxy-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]benzamide?
The canonical SMILES for 5-fluoro-2-methoxy-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]benzamide is COc1ccc(F)cc1C(=O)Nc1ccc(-c2csc(N3CCOCC3)n2)cc1.
What is the InChIKey of 5-fluoro-2-methoxy-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]benzamide?
The InChIKey is UZQLHEHLMGRFBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20FN3O3S/c1-27-19-7-4-15(22)12-17(19)20(26)23-16-5-2-14(3-6-16)18-13-29-21(24-18)25-8-10-28-11-9-25/h2-7,12-13H,8-11H2,1H3,(H,23,26).
What are the key properties of 5-fluoro-2-methoxy-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]benzamide?
5-fluoro-2-methoxy-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]benzamide has a molecular weight of 413.47 g/mol, XLogP of 4.05, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2-methoxy-N-[4-(2-morpholin-4-yl-1,3-thiazol-4-yl)phenyl]benzamide is sourced from PubChem (CID 26012155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).