2-(4-methoxyphenoxy)-N-[(3-methylthiophen-2-yl)methyl]acetamide

C15H17NO3S — CID 32959031

IUPAC2-(4-methoxyphenoxy)-N-[(3-methylthiophen-2-yl)methyl]acetamide
SMILESCOc1ccc(OCC(=O)NCc2sccc2C)cc1
InChIInChI=1S/C15H17NO3S/c1-11-7-8-20-14(11)9-16-15(17)10-19-13-5-3-12(18-2)4-6-13/h3-8H,9-10H2,1-2H3,(H,16,17)
InChIKeyGGVUACOVDPADAN-UHFFFAOYSA-N
MW291.37 g/mol
LogP2.76
Rot. Bonds6

About 2-(4-methoxyphenoxy)-N-[(3-methylthiophen-2-yl)methyl]acetamide

2-(4-methoxyphenoxy)-N-[(3-methylthiophen-2-yl)methyl]acetamide (PubChem CID 32959031) has the molecular formula C15H17NO3S and a molecular weight of 291.37 g/mol. Its IUPAC name is 2-(4-methoxyphenoxy)-N-[(3-methylthiophen-2-yl)methyl]acetamide.

Molecular Properties

Compound Name2-(4-methoxyphenoxy)-N-[(3-methylthiophen-2-yl)methyl]acetamide
PubChem CID32959031
Molecular FormulaC15H17NO3S
Molecular Weight291.37 g/mol
Exact Mass291.09
IUPAC Name2-(4-methoxyphenoxy)-N-[(3-methylthiophen-2-yl)methyl]acetamide
SMILESCOc1ccc(OCC(=O)NCc2sccc2C)cc1
InChIInChI=1S/C15H17NO3S/c1-11-7-8-20-14(11)9-16-15(17)10-19-13-5-3-12(18-2)4-6-13/h3-8H,9-10H2,1-2H3,(H,16,17)
InChIKeyGGVUACOVDPADAN-UHFFFAOYSA-N
XLogP2.76
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.37
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-aminophenoxy)-N-[(3-methylthiophen-2-yl)methyl]acetamide
CID 78985015
2-(4-ethylphenoxy)-N-[(3-methylthiophen-2-yl)methyl]acetamide
CID 32959130
2-[3-(1-hydroxyethyl)phenoxy]-N-[(3-methylthiophen-2-yl)methyl]acetamide
CID 71968834
2-(4-methoxyphenoxy)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]acetamide
CID 23612988
N-[(4-methoxyphenyl)methyl]-2-[[N'-methyl-N-[(3-methylthiophen-2-yl)methyl]carbamimidoyl]amino]acetamide
CID 111893367
2-(5,6-dimethylpyridazin-3-yl)oxy-N-[(3-methylthiophen-2-yl)methyl]acetamide
CID 56782751
N-[(3-methylthiophen-2-yl)methyl]-4-phenoxybutanamide
CID 134056517
1-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-3-[(3-methylthiophen-2-yl)methyl]urea
CID 110893691
N-[(4,6-dimethoxy-1,3,5-triazin-2-yl)methyl]-2-(4-fluorophenoxy)acetamide
CID 121137422
2-[4-[2-(4-fluorophenoxy)acetyl]piperazin-1-yl]-N-[(3-methylthiophen-2-yl)methyl]acetamide
CID 78897047
3-(2-methoxyphenoxy)-N-[(3-methylthiophen-2-yl)methyl]propanamide
CID 134056529
N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-2-(4-methoxyphenoxy)acetamide
CID 134027741

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenoxy)-N-[(3-methylthiophen-2-yl)methyl]acetamide?
The IUPAC name of 2-(4-methoxyphenoxy)-N-[(3-methylthiophen-2-yl)methyl]acetamide (CID 32959031) is 2-(4-methoxyphenoxy)-N-[(3-methylthiophen-2-yl)methyl]acetamide.
What is the SMILES notation for 2-(4-methoxyphenoxy)-N-[(3-methylthiophen-2-yl)methyl]acetamide?
The canonical SMILES for 2-(4-methoxyphenoxy)-N-[(3-methylthiophen-2-yl)methyl]acetamide is COc1ccc(OCC(=O)NCc2sccc2C)cc1.
What is the InChIKey of 2-(4-methoxyphenoxy)-N-[(3-methylthiophen-2-yl)methyl]acetamide?
The InChIKey is GGVUACOVDPADAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO3S/c1-11-7-8-20-14(11)9-16-15(17)10-19-13-5-3-12(18-2)4-6-13/h3-8H,9-10H2,1-2H3,(H,16,17).
What are the key properties of 2-(4-methoxyphenoxy)-N-[(3-methylthiophen-2-yl)methyl]acetamide?
2-(4-methoxyphenoxy)-N-[(3-methylthiophen-2-yl)methyl]acetamide has a molecular weight of 291.37 g/mol, XLogP of 2.76, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenoxy)-N-[(3-methylthiophen-2-yl)methyl]acetamide is sourced from PubChem (CID 32959031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).