N-(2,5-dimethoxyphenyl)-5-methylsulfanylthiophene-2-carboxamide

C14H15NO3S2 — CID 2740430

IUPACN-(2,5-dimethoxyphenyl)-5-methylsulfanylthiophene-2-carboxamide
SMILESCOc1ccc(OC)c(NC(=O)c2ccc(SC)s2)c1
InChIInChI=1S/C14H15NO3S2/c1-17-9-4-5-11(18-2)10(8-9)15-14(16)12-6-7-13(19-3)20-12/h4-8H,1-3H3,(H,15,16)
InChIKeyAHGZMQBVJMLKNB-UHFFFAOYSA-N
MW309.41 g/mol
LogP3.74
Rot. Bonds5

About N-(2,5-dimethoxyphenyl)-5-methylsulfanylthiophene-2-carboxamide

N-(2,5-dimethoxyphenyl)-5-methylsulfanylthiophene-2-carboxamide (PubChem CID 2740430) has the molecular formula C14H15NO3S2 and a molecular weight of 309.41 g/mol. Its IUPAC name is N-(2,5-dimethoxyphenyl)-5-methylsulfanylthiophene-2-carboxamide.

Molecular Properties

Compound NameN-(2,5-dimethoxyphenyl)-5-methylsulfanylthiophene-2-carboxamide
PubChem CID2740430
Molecular FormulaC14H15NO3S2
Molecular Weight309.41 g/mol
Exact Mass309.05
IUPAC NameN-(2,5-dimethoxyphenyl)-5-methylsulfanylthiophene-2-carboxamide
SMILESCOc1ccc(OC)c(NC(=O)c2ccc(SC)s2)c1
InChIInChI=1S/C14H15NO3S2/c1-17-9-4-5-11(18-2)10(8-9)15-14(16)12-6-7-13(19-3)20-12/h4-8H,1-3H3,(H,15,16)
InChIKeyAHGZMQBVJMLKNB-UHFFFAOYSA-N
XLogP3.74
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.41
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2,4-dimethoxyphenyl)-5-methylthiophene-2-carboxamide
CID 7930911
N-(2,5-dimethoxyphenyl)-1-benzothiophene-2-carboxamide
CID 27844583
N-(2,5-dimethoxyphenyl)-2-methylsulfanylbenzamide
CID 966884
N-(2,5-dimethoxyphenyl)-5,6-dihydro-4H-cyclopenta[b]thiophene-2-carboxamide
CID 2348568
N-(5-bromo-2-methoxyphenyl)-5-methylthiophene-2-carboxamide
CID 61074376
N-(2,5-dimethoxyphenyl)-2-phenyl-1,3-thiazole-5-carboxamide
CID 46460468
N-(2,5-dimethoxyphenyl)-3,5-dimethylbenzamide
CID 918722
methyl 4-[(2,5-dimethoxyphenyl)carbamoyl]benzoate
CID 16585566
N-(2-amino-5-methoxyphenyl)-5-methylthiophene-2-carboxamide
CID 63258266
N-(2,5-dimethoxyphenyl)prop-2-enamide
CID 881958
N,N'-bis(2,5-dimethoxyphenyl)butanediamide
CID 1011774
N-(2,5-dimethoxyphenyl)-3-fluoropyridine-4-carboxamide
CID 115645348

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethoxyphenyl)-5-methylsulfanylthiophene-2-carboxamide?
The IUPAC name of N-(2,5-dimethoxyphenyl)-5-methylsulfanylthiophene-2-carboxamide (CID 2740430) is N-(2,5-dimethoxyphenyl)-5-methylsulfanylthiophene-2-carboxamide.
What is the SMILES notation for N-(2,5-dimethoxyphenyl)-5-methylsulfanylthiophene-2-carboxamide?
The canonical SMILES for N-(2,5-dimethoxyphenyl)-5-methylsulfanylthiophene-2-carboxamide is COc1ccc(OC)c(NC(=O)c2ccc(SC)s2)c1.
What is the InChIKey of N-(2,5-dimethoxyphenyl)-5-methylsulfanylthiophene-2-carboxamide?
The InChIKey is AHGZMQBVJMLKNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO3S2/c1-17-9-4-5-11(18-2)10(8-9)15-14(16)12-6-7-13(19-3)20-12/h4-8H,1-3H3,(H,15,16).
What are the key properties of N-(2,5-dimethoxyphenyl)-5-methylsulfanylthiophene-2-carboxamide?
N-(2,5-dimethoxyphenyl)-5-methylsulfanylthiophene-2-carboxamide has a molecular weight of 309.41 g/mol, XLogP of 3.74, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethoxyphenyl)-5-methylsulfanylthiophene-2-carboxamide is sourced from PubChem (CID 2740430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).