2-[2-(4-fluorophenyl)-1,3-thiazol-4-yl]-N-(6-morpholin-4-yl-3-pyridinyl)acetamide

C20H19FN4O2S — CID 17497154

IUPAC2-[2-(4-fluorophenyl)-1,3-thiazol-4-yl]-N-(6-morpholin-4-yl-3-pyridinyl)acetamide
SMILESO=C(Cc1csc(-c2ccc(F)cc2)n1)Nc1ccc(N2CCOCC2)nc1
InChIInChI=1S/C20H19FN4O2S/c21-15-3-1-14(2-4-15)20-24-17(13-28-20)11-19(26)23-16-5-6-18(22-12-16)25-7-9-27-10-8-25/h1-6,12-13H,7-11H2,(H,23,26)
InChIKeyQALWHGWIUSBTMB-UHFFFAOYSA-N
MW398.46 g/mol
LogP3.36
Rot. Bonds5

About 2-[2-(4-fluorophenyl)-1,3-thiazol-4-yl]-N-(6-morpholin-4-yl-3-pyridinyl)acetamide

2-[2-(4-fluorophenyl)-1,3-thiazol-4-yl]-N-(6-morpholin-4-yl-3-pyridinyl)acetamide (PubChem CID 17497154) has the molecular formula C20H19FN4O2S and a molecular weight of 398.46 g/mol. Its IUPAC name is 2-[2-(4-fluorophenyl)-1,3-thiazol-4-yl]-N-(6-morpholin-4-yl-3-pyridinyl)acetamide.

Molecular Properties

Compound Name2-[2-(4-fluorophenyl)-1,3-thiazol-4-yl]-N-(6-morpholin-4-yl-3-pyridinyl)acetamide
PubChem CID17497154
Molecular FormulaC20H19FN4O2S
Molecular Weight398.46 g/mol
Exact Mass398.12
IUPAC Name2-[2-(4-fluorophenyl)-1,3-thiazol-4-yl]-N-(6-morpholin-4-yl-3-pyridinyl)acetamide
SMILESO=C(Cc1csc(-c2ccc(F)cc2)n1)Nc1ccc(N2CCOCC2)nc1
InChIInChI=1S/C20H19FN4O2S/c21-15-3-1-14(2-4-15)20-24-17(13-28-20)11-19(26)23-16-5-6-18(22-12-16)25-7-9-27-10-8-25/h1-6,12-13H,7-11H2,(H,23,26)
InChIKeyQALWHGWIUSBTMB-UHFFFAOYSA-N
XLogP3.36
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.46
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-[2-(4-fluorophenyl)-1,3-thiazol-4-yl]-N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]acetamide
CID 16556831
2-(3,4-dichlorophenyl)-N-(6-morpholin-4-yl-3-pyridinyl)acetamide
CID 17453496
N-(4-fluorophenyl)-2-(2-morpholin-4-yl-4-pyridinyl)-1,3-thiazole-4-carboxamide
CID 53119213
3-[(6-morpholin-4-yl-3-pyridinyl)amino]-3-oxopropanoic acid
CID 62229953
2-(4-fluorophenyl)-N-[6-(4-formylpiperazin-1-yl)-3-pyridinyl]acetamide
CID 113011137
N-[6-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-3-pyridinyl]-2-(4-fluorophenyl)acetamide
CID 113014066
2-(2,3-dihydro-1H-inden-5-yl)-N-(6-morpholin-4-yl-3-pyridinyl)acetamide
CID 43038081
2-[2-(4-fluorophenyl)-1,3-thiazol-4-yl]-N-(1H-indol-6-yl)acetamide
CID 39349699
4-[(6-morpholin-4-yl-3-pyridinyl)amino]-4-oxobutanoic acid
CID 39180266
N-(3,5-dimethoxyphenyl)-2-[2-(4-fluorophenyl)-1,3-thiazol-4-yl]acetamide
CID 8572766
N-(5-chloro-2-pyridinyl)-2-[2-(4-fluorophenyl)-1,3-thiazol-4-yl]acetamide
CID 34136046
2-(2,6-dichlorophenyl)-N-(6-morpholin-4-yl-3-pyridinyl)acetamide
CID 30770460

Frequently Asked Questions

What is the IUPAC name of 2-[2-(4-fluorophenyl)-1,3-thiazol-4-yl]-N-(6-morpholin-4-yl-3-pyridinyl)acetamide?
The IUPAC name of 2-[2-(4-fluorophenyl)-1,3-thiazol-4-yl]-N-(6-morpholin-4-yl-3-pyridinyl)acetamide (CID 17497154) is 2-[2-(4-fluorophenyl)-1,3-thiazol-4-yl]-N-(6-morpholin-4-yl-3-pyridinyl)acetamide.
What is the SMILES notation for 2-[2-(4-fluorophenyl)-1,3-thiazol-4-yl]-N-(6-morpholin-4-yl-3-pyridinyl)acetamide?
The canonical SMILES for 2-[2-(4-fluorophenyl)-1,3-thiazol-4-yl]-N-(6-morpholin-4-yl-3-pyridinyl)acetamide is O=C(Cc1csc(-c2ccc(F)cc2)n1)Nc1ccc(N2CCOCC2)nc1.
What is the InChIKey of 2-[2-(4-fluorophenyl)-1,3-thiazol-4-yl]-N-(6-morpholin-4-yl-3-pyridinyl)acetamide?
The InChIKey is QALWHGWIUSBTMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19FN4O2S/c21-15-3-1-14(2-4-15)20-24-17(13-28-20)11-19(26)23-16-5-6-18(22-12-16)25-7-9-27-10-8-25/h1-6,12-13H,7-11H2,(H,23,26).
What are the key properties of 2-[2-(4-fluorophenyl)-1,3-thiazol-4-yl]-N-(6-morpholin-4-yl-3-pyridinyl)acetamide?
2-[2-(4-fluorophenyl)-1,3-thiazol-4-yl]-N-(6-morpholin-4-yl-3-pyridinyl)acetamide has a molecular weight of 398.46 g/mol, XLogP of 3.36, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(4-fluorophenyl)-1,3-thiazol-4-yl]-N-(6-morpholin-4-yl-3-pyridinyl)acetamide is sourced from PubChem (CID 17497154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).