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

C13H14N2O2S — CID 75419578

IUPAC2-(3-methyl-2-oxo-1-pyridinyl)-N-(thiophen-2-ylmethyl)acetamide
SMILESCc1cccn(CC(=O)NCc2cccs2)c1=O
InChIInChI=1S/C13H14N2O2S/c1-10-4-2-6-15(13(10)17)9-12(16)14-8-11-5-3-7-18-11/h2-7H,8-9H2,1H3,(H,14,16)
InChIKeyAPQCMWMZQLMKFR-UHFFFAOYSA-N
MW262.33 g/mol
LogP1.53
Rot. Bonds4

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

2-(3-methyl-2-oxo-1-pyridinyl)-N-(thiophen-2-ylmethyl)acetamide (PubChem CID 75419578) has the molecular formula C13H14N2O2S and a molecular weight of 262.33 g/mol. Its IUPAC name is 2-(3-methyl-2-oxo-1-pyridinyl)-N-(thiophen-2-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(3-methyl-2-oxo-1-pyridinyl)-N-(thiophen-2-ylmethyl)acetamide
PubChem CID75419578
Molecular FormulaC13H14N2O2S
Molecular Weight262.33 g/mol
Exact Mass262.08
IUPAC Name2-(3-methyl-2-oxo-1-pyridinyl)-N-(thiophen-2-ylmethyl)acetamide
SMILESCc1cccn(CC(=O)NCc2cccs2)c1=O
InChIInChI=1S/C13H14N2O2S/c1-10-4-2-6-15(13(10)17)9-12(16)14-8-11-5-3-7-18-11/h2-7H,8-9H2,1H3,(H,14,16)
InChIKeyAPQCMWMZQLMKFR-UHFFFAOYSA-N
XLogP1.53
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.33
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(3-methyl-2-oxo-1-pyridinyl)-N-(thiophen-2-ylmethyl)acetamide?
The IUPAC name of 2-(3-methyl-2-oxo-1-pyridinyl)-N-(thiophen-2-ylmethyl)acetamide (CID 75419578) is 2-(3-methyl-2-oxo-1-pyridinyl)-N-(thiophen-2-ylmethyl)acetamide.
What is the SMILES notation for 2-(3-methyl-2-oxo-1-pyridinyl)-N-(thiophen-2-ylmethyl)acetamide?
The canonical SMILES for 2-(3-methyl-2-oxo-1-pyridinyl)-N-(thiophen-2-ylmethyl)acetamide is Cc1cccn(CC(=O)NCc2cccs2)c1=O.
What is the InChIKey of 2-(3-methyl-2-oxo-1-pyridinyl)-N-(thiophen-2-ylmethyl)acetamide?
The InChIKey is APQCMWMZQLMKFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O2S/c1-10-4-2-6-15(13(10)17)9-12(16)14-8-11-5-3-7-18-11/h2-7H,8-9H2,1H3,(H,14,16).
What are the key properties of 2-(3-methyl-2-oxo-1-pyridinyl)-N-(thiophen-2-ylmethyl)acetamide?
2-(3-methyl-2-oxo-1-pyridinyl)-N-(thiophen-2-ylmethyl)acetamide has a molecular weight of 262.33 g/mol, XLogP of 1.53, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methyl-2-oxo-1-pyridinyl)-N-(thiophen-2-ylmethyl)acetamide is sourced from PubChem (CID 75419578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).