N-(3-methoxyphenyl)thiophene-2-carboxamide

C12H11NO2S — CID 790310

IUPACN-(3-methoxyphenyl)thiophene-2-carboxamide
SMILESCOc1cccc(NC(=O)c2cccs2)c1
InChIInChI=1S/C12H11NO2S/c1-15-10-5-2-4-9(8-10)13-12(14)11-6-3-7-16-11/h2-8H,1H3,(H,13,14)
InChIKeyZSPOYUQATHVQLV-UHFFFAOYSA-N
MW233.29 g/mol
LogP3.01
Rot. Bonds3

About N-(3-methoxyphenyl)thiophene-2-carboxamide

N-(3-methoxyphenyl)thiophene-2-carboxamide (PubChem CID 790310) has the molecular formula C12H11NO2S and a molecular weight of 233.29 g/mol. Its IUPAC name is N-(3-methoxyphenyl)thiophene-2-carboxamide.

Molecular Properties

Compound NameN-(3-methoxyphenyl)thiophene-2-carboxamide
PubChem CID790310
Molecular FormulaC12H11NO2S
Molecular Weight233.29 g/mol
Exact Mass233.05
IUPAC NameN-(3-methoxyphenyl)thiophene-2-carboxamide
SMILESCOc1cccc(NC(=O)c2cccs2)c1
InChIInChI=1S/C12H11NO2S/c1-15-10-5-2-4-9(8-10)13-12(14)11-6-3-7-16-11/h2-8H,1H3,(H,13,14)
InChIKeyZSPOYUQATHVQLV-UHFFFAOYSA-N
XLogP3.01
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.29
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3-methoxyphenyl)thiophene-2-carboxamide?
The IUPAC name of N-(3-methoxyphenyl)thiophene-2-carboxamide (CID 790310) is N-(3-methoxyphenyl)thiophene-2-carboxamide.
What is the SMILES notation for N-(3-methoxyphenyl)thiophene-2-carboxamide?
The canonical SMILES for N-(3-methoxyphenyl)thiophene-2-carboxamide is COc1cccc(NC(=O)c2cccs2)c1.
What is the InChIKey of N-(3-methoxyphenyl)thiophene-2-carboxamide?
The InChIKey is ZSPOYUQATHVQLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11NO2S/c1-15-10-5-2-4-9(8-10)13-12(14)11-6-3-7-16-11/h2-8H,1H3,(H,13,14).
What are the key properties of N-(3-methoxyphenyl)thiophene-2-carboxamide?
N-(3-methoxyphenyl)thiophene-2-carboxamide has a molecular weight of 233.29 g/mol, XLogP of 3.01, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxyphenyl)thiophene-2-carboxamide is sourced from PubChem (CID 790310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).