N-(3-chloro-4-fluorophenyl)-2-(2-morpholin-4-yl-4-oxo-1,3-thiazol-5-yl)acetamide

C15H15ClFN3O3S — CID 4818716

IUPACN-(3-chloro-4-fluorophenyl)-2-(2-morpholin-4-yl-4-oxo-1,3-thiazol-5-yl)acetamide
SMILESO=C(CC1SC(N2CCOCC2)=NC1=O)Nc1ccc(F)c(Cl)c1
InChIInChI=1S/C15H15ClFN3O3S/c16-10-7-9(1-2-11(10)17)18-13(21)8-12-14(22)19-15(24-12)20-3-5-23-6-4-20/h1-2,7,12H,3-6,8H2,(H,18,21)
InChIKeyWOBUWVGGEWWBFF-UHFFFAOYSA-N
MW371.82 g/mol
LogP2.14
Rot. Bonds3

About N-(3-chloro-4-fluorophenyl)-2-(2-morpholin-4-yl-4-oxo-1,3-thiazol-5-yl)acetamide

N-(3-chloro-4-fluorophenyl)-2-(2-morpholin-4-yl-4-oxo-1,3-thiazol-5-yl)acetamide (PubChem CID 4818716) has the molecular formula C15H15ClFN3O3S and a molecular weight of 371.82 g/mol. Its IUPAC name is N-(3-chloro-4-fluorophenyl)-2-(2-morpholin-4-yl-4-oxo-1,3-thiazol-5-yl)acetamide.

Molecular Properties

Compound NameN-(3-chloro-4-fluorophenyl)-2-(2-morpholin-4-yl-4-oxo-1,3-thiazol-5-yl)acetamide
PubChem CID4818716
Molecular FormulaC15H15ClFN3O3S
Molecular Weight371.82 g/mol
Exact Mass371.05
IUPAC NameN-(3-chloro-4-fluorophenyl)-2-(2-morpholin-4-yl-4-oxo-1,3-thiazol-5-yl)acetamide
SMILESO=C(CC1SC(N2CCOCC2)=NC1=O)Nc1ccc(F)c(Cl)c1
InChIInChI=1S/C15H15ClFN3O3S/c16-10-7-9(1-2-11(10)17)18-13(21)8-12-14(22)19-15(24-12)20-3-5-23-6-4-20/h1-2,7,12H,3-6,8H2,(H,18,21)
InChIKeyWOBUWVGGEWWBFF-UHFFFAOYSA-N
XLogP2.14
TPSA71.00 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.82
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(2Z)-N-(3-chlorophenyl)-3-ethyl-2-(ethylimino)-4-oxo-1,3-thiazinane-6-carboxamide
CID 3139557
(2Z)-N-(3,4-dichlorophenyl)-3-ethyl-2-(ethylimino)-4-oxo-1,3-thiazinane-6-carboxamide
CID 661493
N-[3-chloro-4-(morpholin-4-yl)phenyl]-2-[(6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]acetamide
CID 6463168
N-(4-chlorophenyl)-2-(2-morpholin-4-yl-4-oxo-1,3-thiazol-5-yl)acetamide
CID 16303723
N-(2-chlorophenyl)-2-[2-(morpholin-4-yl)-4-oxo-4,5-dihydro-1,3-thiazol-5-yl]acetamide
CID 16304239
N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[2-(morpholin-4-yl)-4-oxo-4,5-dihydro-1,3-thiazol-5-yl]acetamide
CID 3645905
N-(4-fluorophenyl)-2-(2-morpholin-4-yl-4-oxo-1,3-thiazol-5-yl)acetamide
CID 4330211
N-(2-fluorophenyl)-2-(2-morpholin-4-yl-4-oxo-1,3-thiazol-5-yl)acetamide
CID 4818714
N-(3,5-Dichlorophenyl)-3-ethyl-2-(ethylimino)-4-oxo-1,3-thiazinane-6-carboxamide
CID 3139566
N-(4-chlorophenyl)-2-[2-(3-methoxypropylimino)-4-oxo-1,3-thiazolidin-5-yl]acetamide
CID 135488861
2-[(4-chlorophenyl)imino]-N-(2-fluorophenyl)-3-methyl-4-oxo-1,3-thiazinane-6-carboxamide
CID 3139997
(2Z)-2-[(3-chlorophenyl)imino]-N-(2-fluorophenyl)-3-methyl-4-oxo-1,3-thiazinane-6-carboxamide
CID 3722340

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-4-fluorophenyl)-2-(2-morpholin-4-yl-4-oxo-1,3-thiazol-5-yl)acetamide?
The IUPAC name of N-(3-chloro-4-fluorophenyl)-2-(2-morpholin-4-yl-4-oxo-1,3-thiazol-5-yl)acetamide (CID 4818716) is N-(3-chloro-4-fluorophenyl)-2-(2-morpholin-4-yl-4-oxo-1,3-thiazol-5-yl)acetamide.
What is the SMILES notation for N-(3-chloro-4-fluorophenyl)-2-(2-morpholin-4-yl-4-oxo-1,3-thiazol-5-yl)acetamide?
The canonical SMILES for N-(3-chloro-4-fluorophenyl)-2-(2-morpholin-4-yl-4-oxo-1,3-thiazol-5-yl)acetamide is O=C(CC1SC(N2CCOCC2)=NC1=O)Nc1ccc(F)c(Cl)c1.
What is the InChIKey of N-(3-chloro-4-fluorophenyl)-2-(2-morpholin-4-yl-4-oxo-1,3-thiazol-5-yl)acetamide?
The InChIKey is WOBUWVGGEWWBFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClFN3O3S/c16-10-7-9(1-2-11(10)17)18-13(21)8-12-14(22)19-15(24-12)20-3-5-23-6-4-20/h1-2,7,12H,3-6,8H2,(H,18,21).
What are the key properties of N-(3-chloro-4-fluorophenyl)-2-(2-morpholin-4-yl-4-oxo-1,3-thiazol-5-yl)acetamide?
N-(3-chloro-4-fluorophenyl)-2-(2-morpholin-4-yl-4-oxo-1,3-thiazol-5-yl)acetamide has a molecular weight of 371.82 g/mol, XLogP of 2.14, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-4-fluorophenyl)-2-(2-morpholin-4-yl-4-oxo-1,3-thiazol-5-yl)acetamide is sourced from PubChem (CID 4818716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).