2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)acetamide

C16H14N6O2S2 — CID 55810226

IUPAC2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)acetamide
SMILESO=C(Cc1csc(N2CCCC2=O)n1)Nc1nnc(-c2ccccn2)s1
InChIInChI=1S/C16H14N6O2S2/c23-12(8-10-9-25-16(18-10)22-7-3-5-13(22)24)19-15-21-20-14(26-15)11-4-1-2-6-17-11/h1-2,4,6,9H,3,5,7-8H2,(H,19,21,23)
InChIKeyDQMJIJYYGYXTON-UHFFFAOYSA-N
MW386.46 g/mol
LogP2.36
Rot. Bonds5

About 2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)acetamide

2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)acetamide (PubChem CID 55810226) has the molecular formula C16H14N6O2S2 and a molecular weight of 386.46 g/mol. Its IUPAC name is 2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)acetamide
PubChem CID55810226
Molecular FormulaC16H14N6O2S2
Molecular Weight386.46 g/mol
Exact Mass386.06
IUPAC Name2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)acetamide
SMILESO=C(Cc1csc(N2CCCC2=O)n1)Nc1nnc(-c2ccccn2)s1
InChIInChI=1S/C16H14N6O2S2/c23-12(8-10-9-25-16(18-10)22-7-3-5-13(22)24)19-15-21-20-14(26-15)11-4-1-2-6-17-11/h1-2,4,6,9H,3,5,7-8H2,(H,19,21,23)
InChIKeyDQMJIJYYGYXTON-UHFFFAOYSA-N
XLogP2.36
TPSA100.97 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.46
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Related Compounds

2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]-N-[phenyl(pyridin-2-yl)methyl]acetamide
CID 51211808
N-(2-methoxyphenyl)-2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]acetamide
CID 27824972
2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]-N-(2-phenylsulfanylphenyl)acetamide
CID 38169001
methyl 2-[[2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]acetyl]amino]benzoate
CID 18200073
N-[2-(ethylaminomethyl)phenyl]-2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]acetamide;dihydrochloride
CID 119439649
2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]-N-[6-(2,2,2-trifluoroethoxy)-1,3-benzothiazol-2-yl]acetamide
CID 39055041
N-[5-[(3-chlorophenyl)methyl]-1,3-thiazol-2-yl]-2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]acetamide
CID 42353461
(2-anilino-2-oxoethyl) 2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]acetate
CID 8667672
2-(2-pyridin-2-yl-1,3-thiazol-4-yl)-N-(5,6,7,8-tetrahydro-4H-cyclohepta[d][1,3]thiazol-2-yl)acetamide
CID 16605145
N-(2,5-dibromophenyl)-2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]acetamide
CID 39166455
N-[5-[(2-fluorophenyl)methyl]-1,3,4-thiadiazol-2-yl]-2-[2-(2-oxo-1,3-diazinan-1-yl)-1,3-thiazol-4-yl]acetamide
CID 86900004
N-(2,2-dimethylpropyl)-2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]acetamide
CID 75416990

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)acetamide?
The IUPAC name of 2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)acetamide (CID 55810226) is 2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)acetamide.
What is the SMILES notation for 2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)acetamide?
The canonical SMILES for 2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)acetamide is O=C(Cc1csc(N2CCCC2=O)n1)Nc1nnc(-c2ccccn2)s1.
What is the InChIKey of 2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)acetamide?
The InChIKey is DQMJIJYYGYXTON-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N6O2S2/c23-12(8-10-9-25-16(18-10)22-7-3-5-13(22)24)19-15-21-20-14(26-15)11-4-1-2-6-17-11/h1-2,4,6,9H,3,5,7-8H2,(H,19,21,23).
What are the key properties of 2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)acetamide?
2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)acetamide has a molecular weight of 386.46 g/mol, XLogP of 2.36, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)acetamide is sourced from PubChem (CID 55810226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).