N-(4-methoxy-2-pyridinyl)-2-thiophen-2-ylacetamide

C12H12N2O2S — CID 75435246

IUPACN-(4-methoxy-2-pyridinyl)-2-thiophen-2-ylacetamide
SMILESCOc1ccnc(NC(=O)Cc2cccs2)c1
InChIInChI=1S/C12H12N2O2S/c1-16-9-4-5-13-11(7-9)14-12(15)8-10-3-2-6-17-10/h2-7H,8H2,1H3,(H,13,14,15)
InChIKeyQOYMIIHPVUJOHY-UHFFFAOYSA-N
MW248.31 g/mol
LogP2.33
Rot. Bonds4

About N-(4-methoxy-2-pyridinyl)-2-thiophen-2-ylacetamide

N-(4-methoxy-2-pyridinyl)-2-thiophen-2-ylacetamide (PubChem CID 75435246) has the molecular formula C12H12N2O2S and a molecular weight of 248.31 g/mol. Its IUPAC name is N-(4-methoxy-2-pyridinyl)-2-thiophen-2-ylacetamide.

Molecular Properties

Compound NameN-(4-methoxy-2-pyridinyl)-2-thiophen-2-ylacetamide
PubChem CID75435246
Molecular FormulaC12H12N2O2S
Molecular Weight248.31 g/mol
Exact Mass248.06
IUPAC NameN-(4-methoxy-2-pyridinyl)-2-thiophen-2-ylacetamide
SMILESCOc1ccnc(NC(=O)Cc2cccs2)c1
InChIInChI=1S/C12H12N2O2S/c1-16-9-4-5-13-11(7-9)14-12(15)8-10-3-2-6-17-10/h2-7H,8H2,1H3,(H,13,14,15)
InChIKeyQOYMIIHPVUJOHY-UHFFFAOYSA-N
XLogP2.33
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.31
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4-methoxy-2-pyridinyl)-2-thiophen-2-ylacetamide?
The IUPAC name of N-(4-methoxy-2-pyridinyl)-2-thiophen-2-ylacetamide (CID 75435246) is N-(4-methoxy-2-pyridinyl)-2-thiophen-2-ylacetamide.
What is the SMILES notation for N-(4-methoxy-2-pyridinyl)-2-thiophen-2-ylacetamide?
The canonical SMILES for N-(4-methoxy-2-pyridinyl)-2-thiophen-2-ylacetamide is COc1ccnc(NC(=O)Cc2cccs2)c1.
What is the InChIKey of N-(4-methoxy-2-pyridinyl)-2-thiophen-2-ylacetamide?
The InChIKey is QOYMIIHPVUJOHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O2S/c1-16-9-4-5-13-11(7-9)14-12(15)8-10-3-2-6-17-10/h2-7H,8H2,1H3,(H,13,14,15).
What are the key properties of N-(4-methoxy-2-pyridinyl)-2-thiophen-2-ylacetamide?
N-(4-methoxy-2-pyridinyl)-2-thiophen-2-ylacetamide has a molecular weight of 248.31 g/mol, XLogP of 2.33, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxy-2-pyridinyl)-2-thiophen-2-ylacetamide is sourced from PubChem (CID 75435246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).