2-(5-amino-2-oxo-1-pyridinyl)-N-(thiophen-3-ylmethyl)acetamide

C12H13N3O2S — CID 63247653

IUPAC2-(5-amino-2-oxo-1-pyridinyl)-N-(thiophen-3-ylmethyl)acetamide
SMILESNc1ccc(=O)n(CC(=O)NCc2ccsc2)c1
InChIInChI=1S/C12H13N3O2S/c13-10-1-2-12(17)15(6-10)7-11(16)14-5-9-3-4-18-8-9/h1-4,6,8H,5,7,13H2,(H,14,16)
InChIKeyIUIKPFDTMRZLTJ-UHFFFAOYSA-N
MW263.32 g/mol
LogP0.81
Rot. Bonds4

About 2-(5-amino-2-oxo-1-pyridinyl)-N-(thiophen-3-ylmethyl)acetamide

2-(5-amino-2-oxo-1-pyridinyl)-N-(thiophen-3-ylmethyl)acetamide (PubChem CID 63247653) has the molecular formula C12H13N3O2S and a molecular weight of 263.32 g/mol. Its IUPAC name is 2-(5-amino-2-oxo-1-pyridinyl)-N-(thiophen-3-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(5-amino-2-oxo-1-pyridinyl)-N-(thiophen-3-ylmethyl)acetamide
PubChem CID63247653
Molecular FormulaC12H13N3O2S
Molecular Weight263.32 g/mol
Exact Mass263.07
IUPAC Name2-(5-amino-2-oxo-1-pyridinyl)-N-(thiophen-3-ylmethyl)acetamide
SMILESNc1ccc(=O)n(CC(=O)NCc2ccsc2)c1
InChIInChI=1S/C12H13N3O2S/c13-10-1-2-12(17)15(6-10)7-11(16)14-5-9-3-4-18-8-9/h1-4,6,8H,5,7,13H2,(H,14,16)
InChIKeyIUIKPFDTMRZLTJ-UHFFFAOYSA-N
XLogP0.81
TPSA77.12 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.32
LogP ≤ 50.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(5-amino-2-oxo-1-pyridinyl)-N-(thiophen-3-ylmethyl)acetamide?
The IUPAC name of 2-(5-amino-2-oxo-1-pyridinyl)-N-(thiophen-3-ylmethyl)acetamide (CID 63247653) is 2-(5-amino-2-oxo-1-pyridinyl)-N-(thiophen-3-ylmethyl)acetamide.
What is the SMILES notation for 2-(5-amino-2-oxo-1-pyridinyl)-N-(thiophen-3-ylmethyl)acetamide?
The canonical SMILES for 2-(5-amino-2-oxo-1-pyridinyl)-N-(thiophen-3-ylmethyl)acetamide is Nc1ccc(=O)n(CC(=O)NCc2ccsc2)c1.
What is the InChIKey of 2-(5-amino-2-oxo-1-pyridinyl)-N-(thiophen-3-ylmethyl)acetamide?
The InChIKey is IUIKPFDTMRZLTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3O2S/c13-10-1-2-12(17)15(6-10)7-11(16)14-5-9-3-4-18-8-9/h1-4,6,8H,5,7,13H2,(H,14,16).
What are the key properties of 2-(5-amino-2-oxo-1-pyridinyl)-N-(thiophen-3-ylmethyl)acetamide?
2-(5-amino-2-oxo-1-pyridinyl)-N-(thiophen-3-ylmethyl)acetamide has a molecular weight of 263.32 g/mol, XLogP of 0.81, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-amino-2-oxo-1-pyridinyl)-N-(thiophen-3-ylmethyl)acetamide is sourced from PubChem (CID 63247653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).