5-ethyl-4-methyl-N-(4-phenoxyphenyl)thiophene-2-carboxamide

C20H19NO2S — CID 7914877

IUPAC5-ethyl-4-methyl-N-(4-phenoxyphenyl)thiophene-2-carboxamide
SMILESCCc1sc(C(=O)Nc2ccc(Oc3ccccc3)cc2)cc1C
InChIInChI=1S/C20H19NO2S/c1-3-18-14(2)13-19(24-18)20(22)21-15-9-11-17(12-10-15)23-16-7-5-4-6-8-16/h4-13H,3H2,1-2H3,(H,21,22)
InChIKeyGIVSAZASMGPXBX-UHFFFAOYSA-N
MW337.44 g/mol
LogP5.66
Rot. Bonds5

About 5-ethyl-4-methyl-N-(4-phenoxyphenyl)thiophene-2-carboxamide

5-ethyl-4-methyl-N-(4-phenoxyphenyl)thiophene-2-carboxamide (PubChem CID 7914877) has the molecular formula C20H19NO2S and a molecular weight of 337.44 g/mol. Its IUPAC name is 5-ethyl-4-methyl-N-(4-phenoxyphenyl)thiophene-2-carboxamide.

Molecular Properties

Compound Name5-ethyl-4-methyl-N-(4-phenoxyphenyl)thiophene-2-carboxamide
PubChem CID7914877
Molecular FormulaC20H19NO2S
Molecular Weight337.44 g/mol
Exact Mass337.11
IUPAC Name5-ethyl-4-methyl-N-(4-phenoxyphenyl)thiophene-2-carboxamide
SMILESCCc1sc(C(=O)Nc2ccc(Oc3ccccc3)cc2)cc1C
InChIInChI=1S/C20H19NO2S/c1-3-18-14(2)13-19(24-18)20(22)21-15-9-11-17(12-10-15)23-16-7-5-4-6-8-16/h4-13H,3H2,1-2H3,(H,21,22)
InChIKeyGIVSAZASMGPXBX-UHFFFAOYSA-N
XLogP5.66
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500337.44
LogP ≤ 55.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-ethyl-4-methyl-N-[4-(3-methylphenoxy)phenyl]thiophene-2-carboxamide
CID 7925009
5-ethyl-4-methyl-N-(4-methylphenyl)thiophene-2-carboxamide
CID 7733711
N-[4-(dimethylamino)phenyl]-5-ethyl-4-methylthiophene-2-carboxamide
CID 27228669
5-[(5-ethyl-4-methylthiophene-2-carbonyl)amino]-2-hydroxybenzoic acid
CID 43353089
N-[3-[2-(dimethylamino)-2-oxoethoxy]phenyl]-5-ethyl-4-methylthiophene-2-carboxamide
CID 87005827
N-(2-ethoxyphenyl)-5-ethyl-4-methylthiophene-2-carboxamide
CID 4820666
methyl 2-[(5-ethyl-4-methylthiophene-2-carbonyl)amino]benzoate
CID 43403969
methyl 5-[(4-phenoxyphenyl)carbamoyl]thiophene-2-carboxylate
CID 38764463
5-ethyl-N-(2-ethyl-6-methylphenyl)-4-methylthiophene-2-carboxamide
CID 4820644
5-ethyl-4-methyl-N-[2-(methylcarbamoyl)phenyl]thiophene-2-carboxamide
CID 24670328
(2S)-2-cyano-3-(5-ethyl-4-methylthiophen-2-yl)-3-oxo-N-phenylpropanamide
CID 98450182
N-[4-[[(5-ethyl-4-methylthiophene-2-carbonyl)amino]methyl]phenyl]furan-2-carboxamide
CID 51327731

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-4-methyl-N-(4-phenoxyphenyl)thiophene-2-carboxamide?
The IUPAC name of 5-ethyl-4-methyl-N-(4-phenoxyphenyl)thiophene-2-carboxamide (CID 7914877) is 5-ethyl-4-methyl-N-(4-phenoxyphenyl)thiophene-2-carboxamide.
What is the SMILES notation for 5-ethyl-4-methyl-N-(4-phenoxyphenyl)thiophene-2-carboxamide?
The canonical SMILES for 5-ethyl-4-methyl-N-(4-phenoxyphenyl)thiophene-2-carboxamide is CCc1sc(C(=O)Nc2ccc(Oc3ccccc3)cc2)cc1C.
What is the InChIKey of 5-ethyl-4-methyl-N-(4-phenoxyphenyl)thiophene-2-carboxamide?
The InChIKey is GIVSAZASMGPXBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19NO2S/c1-3-18-14(2)13-19(24-18)20(22)21-15-9-11-17(12-10-15)23-16-7-5-4-6-8-16/h4-13H,3H2,1-2H3,(H,21,22).
What are the key properties of 5-ethyl-4-methyl-N-(4-phenoxyphenyl)thiophene-2-carboxamide?
5-ethyl-4-methyl-N-(4-phenoxyphenyl)thiophene-2-carboxamide has a molecular weight of 337.44 g/mol, XLogP of 5.66, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-4-methyl-N-(4-phenoxyphenyl)thiophene-2-carboxamide is sourced from PubChem (CID 7914877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).