2-[[2-(3-methoxyphenyl)acetyl]amino]thiophene-3-carboxamide

C14H14N2O3S — CID 16911507

IUPAC2-[[2-(3-methoxyphenyl)acetyl]amino]thiophene-3-carboxamide
SMILESCOc1cccc(CC(=O)Nc2sccc2C(N)=O)c1
InChIInChI=1S/C14H14N2O3S/c1-19-10-4-2-3-9(7-10)8-12(17)16-14-11(13(15)18)5-6-20-14/h2-7H,8H2,1H3,(H2,15,18)(H,16,17)
InChIKeyYLZQQPSLEOFYLG-UHFFFAOYSA-N
MW290.34 g/mol
LogP2.04
Rot. Bonds5

About 2-[[2-(3-methoxyphenyl)acetyl]amino]thiophene-3-carboxamide

2-[[2-(3-methoxyphenyl)acetyl]amino]thiophene-3-carboxamide (PubChem CID 16911507) has the molecular formula C14H14N2O3S and a molecular weight of 290.34 g/mol. Its IUPAC name is 2-[[2-(3-methoxyphenyl)acetyl]amino]thiophene-3-carboxamide.

Molecular Properties

Compound Name2-[[2-(3-methoxyphenyl)acetyl]amino]thiophene-3-carboxamide
PubChem CID16911507
Molecular FormulaC14H14N2O3S
Molecular Weight290.34 g/mol
Exact Mass290.07
IUPAC Name2-[[2-(3-methoxyphenyl)acetyl]amino]thiophene-3-carboxamide
SMILESCOc1cccc(CC(=O)Nc2sccc2C(N)=O)c1
InChIInChI=1S/C14H14N2O3S/c1-19-10-4-2-3-9(7-10)8-12(17)16-14-11(13(15)18)5-6-20-14/h2-7H,8H2,1H3,(H2,15,18)(H,16,17)
InChIKeyYLZQQPSLEOFYLG-UHFFFAOYSA-N
XLogP2.04
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.34
LogP ≤ 52.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[[2-(3-methoxyphenyl)acetyl]amino]thiophene-3-carboxamide?
The IUPAC name of 2-[[2-(3-methoxyphenyl)acetyl]amino]thiophene-3-carboxamide (CID 16911507) is 2-[[2-(3-methoxyphenyl)acetyl]amino]thiophene-3-carboxamide.
What is the SMILES notation for 2-[[2-(3-methoxyphenyl)acetyl]amino]thiophene-3-carboxamide?
The canonical SMILES for 2-[[2-(3-methoxyphenyl)acetyl]amino]thiophene-3-carboxamide is COc1cccc(CC(=O)Nc2sccc2C(N)=O)c1.
What is the InChIKey of 2-[[2-(3-methoxyphenyl)acetyl]amino]thiophene-3-carboxamide?
The InChIKey is YLZQQPSLEOFYLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O3S/c1-19-10-4-2-3-9(7-10)8-12(17)16-14-11(13(15)18)5-6-20-14/h2-7H,8H2,1H3,(H2,15,18)(H,16,17).
What are the key properties of 2-[[2-(3-methoxyphenyl)acetyl]amino]thiophene-3-carboxamide?
2-[[2-(3-methoxyphenyl)acetyl]amino]thiophene-3-carboxamide has a molecular weight of 290.34 g/mol, XLogP of 2.04, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(3-methoxyphenyl)acetyl]amino]thiophene-3-carboxamide is sourced from PubChem (CID 16911507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).