N-[3-(5-aminothiophen-2-yl)-4-methoxyphenyl]acetamide

C13H14N2O2S — CID 82485607

IUPACN-[3-(5-aminothiophen-2-yl)-4-methoxyphenyl]acetamide
SMILESCOc1ccc(NC(C)=O)cc1-c1ccc(N)s1
InChIInChI=1S/C13H14N2O2S/c1-8(16)15-9-3-4-11(17-2)10(7-9)12-5-6-13(14)18-12/h3-7H,14H2,1-2H3,(H,15,16)
InChIKeyZLAYZRJUMQTRON-UHFFFAOYSA-N
MW262.33 g/mol
LogP2.96
Rot. Bonds3

About N-[3-(5-aminothiophen-2-yl)-4-methoxyphenyl]acetamide

N-[3-(5-aminothiophen-2-yl)-4-methoxyphenyl]acetamide (PubChem CID 82485607) has the molecular formula C13H14N2O2S and a molecular weight of 262.33 g/mol. Its IUPAC name is N-[3-(5-aminothiophen-2-yl)-4-methoxyphenyl]acetamide.

Molecular Properties

Compound NameN-[3-(5-aminothiophen-2-yl)-4-methoxyphenyl]acetamide
PubChem CID82485607
Molecular FormulaC13H14N2O2S
Molecular Weight262.33 g/mol
Exact Mass262.08
IUPAC NameN-[3-(5-aminothiophen-2-yl)-4-methoxyphenyl]acetamide
SMILESCOc1ccc(NC(C)=O)cc1-c1ccc(N)s1
InChIInChI=1S/C13H14N2O2S/c1-8(16)15-9-3-4-11(17-2)10(7-9)12-5-6-13(14)18-12/h3-7H,14H2,1-2H3,(H,15,16)
InChIKeyZLAYZRJUMQTRON-UHFFFAOYSA-N
XLogP2.96
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.33
LogP ≤ 52.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-(4-chlorophenyl)-4-methoxyphenyl]acetamide
CID 10636150
N-(3-cyano-4-methoxyphenyl)acetamide
CID 5070081
N-[4-methoxy-3-[2-methoxy-5-(3-oxobutanoylamino)phenyl]phenyl]-3-oxobutanamide
CID 101275812
2-(5-acetamido-2-methoxyphenyl)acetamide
CID 82494406
N-(4-methoxy-3-methylsulfanylphenyl)acetamide
CID 593064
N-[3-(hydroxymethyl)-4-methoxyphenyl]acetamide
CID 82469130
N-(4-acetyl-3-methoxyphenyl)acetamide
CID 13221159
5-acetamido-2-methoxybenzenesulfinic acid
CID 23466770
N-[3-[4-(5-acetamido-2-methoxyphenyl)-2,5-dioxopiperazin-1-yl]-4-methoxyphenyl]acetamide
CID 45355039
(3,4-dimethoxyphenyl)urea
CID 21197430
N-[3-[5-(aminomethyl)-2-methyl-1,2,4-triazol-3-yl]-4-methoxyphenyl]acetamide
CID 98019158
N-[3-(3-aminopropyl)-4-methoxyphenyl]acetamide
CID 96659275

Frequently Asked Questions

What is the IUPAC name of N-[3-(5-aminothiophen-2-yl)-4-methoxyphenyl]acetamide?
The IUPAC name of N-[3-(5-aminothiophen-2-yl)-4-methoxyphenyl]acetamide (CID 82485607) is N-[3-(5-aminothiophen-2-yl)-4-methoxyphenyl]acetamide.
What is the SMILES notation for N-[3-(5-aminothiophen-2-yl)-4-methoxyphenyl]acetamide?
The canonical SMILES for N-[3-(5-aminothiophen-2-yl)-4-methoxyphenyl]acetamide is COc1ccc(NC(C)=O)cc1-c1ccc(N)s1.
What is the InChIKey of N-[3-(5-aminothiophen-2-yl)-4-methoxyphenyl]acetamide?
The InChIKey is ZLAYZRJUMQTRON-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O2S/c1-8(16)15-9-3-4-11(17-2)10(7-9)12-5-6-13(14)18-12/h3-7H,14H2,1-2H3,(H,15,16).
What are the key properties of N-[3-(5-aminothiophen-2-yl)-4-methoxyphenyl]acetamide?
N-[3-(5-aminothiophen-2-yl)-4-methoxyphenyl]acetamide has a molecular weight of 262.33 g/mol, XLogP of 2.96, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(5-aminothiophen-2-yl)-4-methoxyphenyl]acetamide is sourced from PubChem (CID 82485607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).