N-(1,3-benzothiazol-2-yl)-2-(2-oxo-1-pyridinyl)acetamide

C14H11N3O2S — CID 8571610

IUPACN-(1,3-benzothiazol-2-yl)-2-(2-oxo-1-pyridinyl)acetamide
SMILESO=C(Cn1ccccc1=O)Nc1nc2ccccc2s1
InChIInChI=1S/C14H11N3O2S/c18-12(9-17-8-4-3-7-13(17)19)16-14-15-10-5-1-2-6-11(10)20-14/h1-8H,9H2,(H,15,16,18)
InChIKeySCNNFWDDQDVLDV-UHFFFAOYSA-N
MW285.33 g/mol
LogP2.10
Rot. Bonds3

About N-(1,3-benzothiazol-2-yl)-2-(2-oxo-1-pyridinyl)acetamide

N-(1,3-benzothiazol-2-yl)-2-(2-oxo-1-pyridinyl)acetamide (PubChem CID 8571610) has the molecular formula C14H11N3O2S and a molecular weight of 285.33 g/mol. Its IUPAC name is N-(1,3-benzothiazol-2-yl)-2-(2-oxo-1-pyridinyl)acetamide.

Molecular Properties

Compound NameN-(1,3-benzothiazol-2-yl)-2-(2-oxo-1-pyridinyl)acetamide
PubChem CID8571610
Molecular FormulaC14H11N3O2S
Molecular Weight285.33 g/mol
Exact Mass285.06
IUPAC NameN-(1,3-benzothiazol-2-yl)-2-(2-oxo-1-pyridinyl)acetamide
SMILESO=C(Cn1ccccc1=O)Nc1nc2ccccc2s1
InChIInChI=1S/C14H11N3O2S/c18-12(9-17-8-4-3-7-13(17)19)16-14-15-10-5-1-2-6-11(10)20-14/h1-8H,9H2,(H,15,16,18)
InChIKeySCNNFWDDQDVLDV-UHFFFAOYSA-N
XLogP2.10
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.33
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-(1,3-benzothiazol-2-ylamino)ethyl]-2-(2-oxo-1-pyridinyl)acetamide
CID 47027911
N-(4-methyl-1,3-benzothiazol-2-yl)-2-(2-oxo-1-pyridinyl)acetamide
CID 24644824
N-(1,3-benzothiazol-2-yl)-2-piperidin-1-ylacetamide
CID 788494
N-(1,3-benzothiazol-2-yl)-2-(4,5-dimethyl-6-oxopyrimidin-1-yl)acetamide
CID 43952352
N-(1,3-benzothiazol-2-yl)-2-[4-(furan-2-yl)-6-oxopyrimidin-1-yl]acetamide
CID 121090557
N-(1,3-benzothiazol-2-yl)-2-[(3S,5S)-3,5-dimethylpiperidin-1-yl]acetamide
CID 51435714
N-(1,3-benzothiazol-2-yl)-2-(4-butyl-6-oxopyrimidin-1-yl)acetamide
CID 121063537
N-(1,3-benzothiazol-2-yl)-2-(4-pyrrol-1-ylphenyl)acetamide
CID 43064333
N-(1,3-benzothiazol-2-yl)-2-(1,3-dioxobenzo[de]isoquinolin-2-yl)acetamide
CID 4092896
2-[4-[2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl]piperazin-1-yl]-N-cyclopropylacetamide
CID 71901166
N-(1,3-benzothiazol-2-yl)-2-(4-methylpiperazin-1-yl)acetamide;1-methylpiperazine
CID 160746986
3-amino-N-(1,3-benzothiazol-2-yl)-3-sulfanylidenepropanamide
CID 43120469

Frequently Asked Questions

What is the IUPAC name of N-(1,3-benzothiazol-2-yl)-2-(2-oxo-1-pyridinyl)acetamide?
The IUPAC name of N-(1,3-benzothiazol-2-yl)-2-(2-oxo-1-pyridinyl)acetamide (CID 8571610) is N-(1,3-benzothiazol-2-yl)-2-(2-oxo-1-pyridinyl)acetamide.
What is the SMILES notation for N-(1,3-benzothiazol-2-yl)-2-(2-oxo-1-pyridinyl)acetamide?
The canonical SMILES for N-(1,3-benzothiazol-2-yl)-2-(2-oxo-1-pyridinyl)acetamide is O=C(Cn1ccccc1=O)Nc1nc2ccccc2s1.
What is the InChIKey of N-(1,3-benzothiazol-2-yl)-2-(2-oxo-1-pyridinyl)acetamide?
The InChIKey is SCNNFWDDQDVLDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N3O2S/c18-12(9-17-8-4-3-7-13(17)19)16-14-15-10-5-1-2-6-11(10)20-14/h1-8H,9H2,(H,15,16,18).
What are the key properties of N-(1,3-benzothiazol-2-yl)-2-(2-oxo-1-pyridinyl)acetamide?
N-(1,3-benzothiazol-2-yl)-2-(2-oxo-1-pyridinyl)acetamide has a molecular weight of 285.33 g/mol, XLogP of 2.10, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,3-benzothiazol-2-yl)-2-(2-oxo-1-pyridinyl)acetamide is sourced from PubChem (CID 8571610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).