2-(3-methoxyphenyl)-N-[4-(2-methyl-4-pyridinyl)thiophen-2-yl]acetamide

C19H18N2O2S — CID 24831039

IUPAC2-(3-methoxyphenyl)-N-[4-(2-methyl-4-pyridinyl)thiophen-2-yl]acetamide
SMILESCOc1cccc(CC(=O)Nc2cc(-c3ccnc(C)c3)cs2)c1
InChIInChI=1S/C19H18N2O2S/c1-13-8-15(6-7-20-13)16-11-19(24-12-16)21-18(22)10-14-4-3-5-17(9-14)23-2/h3-9,11-12H,10H2,1-2H3,(H,21,22)
InChIKeyGHFWMHJUWVJOGZ-UHFFFAOYSA-N
MW338.43 g/mol
LogP4.31
Rot. Bonds5

About 2-(3-methoxyphenyl)-N-[4-(2-methyl-4-pyridinyl)thiophen-2-yl]acetamide

2-(3-methoxyphenyl)-N-[4-(2-methyl-4-pyridinyl)thiophen-2-yl]acetamide (PubChem CID 24831039) has the molecular formula C19H18N2O2S and a molecular weight of 338.43 g/mol. Its IUPAC name is 2-(3-methoxyphenyl)-N-[4-(2-methyl-4-pyridinyl)thiophen-2-yl]acetamide.

Molecular Properties

Compound Name2-(3-methoxyphenyl)-N-[4-(2-methyl-4-pyridinyl)thiophen-2-yl]acetamide
PubChem CID24831039
Molecular FormulaC19H18N2O2S
Molecular Weight338.43 g/mol
Exact Mass338.11
IUPAC Name2-(3-methoxyphenyl)-N-[4-(2-methyl-4-pyridinyl)thiophen-2-yl]acetamide
SMILESCOc1cccc(CC(=O)Nc2cc(-c3ccnc(C)c3)cs2)c1
InChIInChI=1S/C19H18N2O2S/c1-13-8-15(6-7-20-13)16-11-19(24-12-16)21-18(22)10-14-4-3-5-17(9-14)23-2/h3-9,11-12H,10H2,1-2H3,(H,21,22)
InChIKeyGHFWMHJUWVJOGZ-UHFFFAOYSA-N
XLogP4.31
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.43
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxyphenyl)-N-[4-(2-methyl-4-pyridinyl)thiophen-2-yl]acetamide?
The IUPAC name of 2-(3-methoxyphenyl)-N-[4-(2-methyl-4-pyridinyl)thiophen-2-yl]acetamide (CID 24831039) is 2-(3-methoxyphenyl)-N-[4-(2-methyl-4-pyridinyl)thiophen-2-yl]acetamide.
What is the SMILES notation for 2-(3-methoxyphenyl)-N-[4-(2-methyl-4-pyridinyl)thiophen-2-yl]acetamide?
The canonical SMILES for 2-(3-methoxyphenyl)-N-[4-(2-methyl-4-pyridinyl)thiophen-2-yl]acetamide is COc1cccc(CC(=O)Nc2cc(-c3ccnc(C)c3)cs2)c1.
What is the InChIKey of 2-(3-methoxyphenyl)-N-[4-(2-methyl-4-pyridinyl)thiophen-2-yl]acetamide?
The InChIKey is GHFWMHJUWVJOGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O2S/c1-13-8-15(6-7-20-13)16-11-19(24-12-16)21-18(22)10-14-4-3-5-17(9-14)23-2/h3-9,11-12H,10H2,1-2H3,(H,21,22).
What are the key properties of 2-(3-methoxyphenyl)-N-[4-(2-methyl-4-pyridinyl)thiophen-2-yl]acetamide?
2-(3-methoxyphenyl)-N-[4-(2-methyl-4-pyridinyl)thiophen-2-yl]acetamide has a molecular weight of 338.43 g/mol, XLogP of 4.31, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxyphenyl)-N-[4-(2-methyl-4-pyridinyl)thiophen-2-yl]acetamide is sourced from PubChem (CID 24831039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).