5-ethyl-2-[(4-methoxybenzoyl)amino]thiophene-3-carboxamide

C15H16N2O3S — CID 842078

IUPAC5-ethyl-2-[(4-methoxybenzoyl)amino]thiophene-3-carboxamide
SMILESCCc1cc(C(N)=O)c(NC(=O)c2ccc(OC)cc2)s1
InChIInChI=1S/C15H16N2O3S/c1-3-11-8-12(13(16)18)15(21-11)17-14(19)9-4-6-10(20-2)7-5-9/h4-8H,3H2,1-2H3,(H2,16,18)(H,17,19)
InChIKeyKVFWTEBBTQBYNR-UHFFFAOYSA-N
MW304.37 g/mol
LogP2.67
Rot. Bonds5

About 5-ethyl-2-[(4-methoxybenzoyl)amino]thiophene-3-carboxamide

5-ethyl-2-[(4-methoxybenzoyl)amino]thiophene-3-carboxamide (PubChem CID 842078) has the molecular formula C15H16N2O3S and a molecular weight of 304.37 g/mol. Its IUPAC name is 5-ethyl-2-[(4-methoxybenzoyl)amino]thiophene-3-carboxamide.

Molecular Properties

Compound Name5-ethyl-2-[(4-methoxybenzoyl)amino]thiophene-3-carboxamide
PubChem CID842078
Molecular FormulaC15H16N2O3S
Molecular Weight304.37 g/mol
Exact Mass304.09
IUPAC Name5-ethyl-2-[(4-methoxybenzoyl)amino]thiophene-3-carboxamide
SMILESCCc1cc(C(N)=O)c(NC(=O)c2ccc(OC)cc2)s1
InChIInChI=1S/C15H16N2O3S/c1-3-11-8-12(13(16)18)15(21-11)17-14(19)9-4-6-10(20-2)7-5-9/h4-8H,3H2,1-2H3,(H2,16,18)(H,17,19)
InChIKeyKVFWTEBBTQBYNR-UHFFFAOYSA-N
XLogP2.67
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.37
LogP ≤ 52.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-2-[(4-methoxybenzoyl)amino]thiophene-3-carboxamide?
The IUPAC name of 5-ethyl-2-[(4-methoxybenzoyl)amino]thiophene-3-carboxamide (CID 842078) is 5-ethyl-2-[(4-methoxybenzoyl)amino]thiophene-3-carboxamide.
What is the SMILES notation for 5-ethyl-2-[(4-methoxybenzoyl)amino]thiophene-3-carboxamide?
The canonical SMILES for 5-ethyl-2-[(4-methoxybenzoyl)amino]thiophene-3-carboxamide is CCc1cc(C(N)=O)c(NC(=O)c2ccc(OC)cc2)s1.
What is the InChIKey of 5-ethyl-2-[(4-methoxybenzoyl)amino]thiophene-3-carboxamide?
The InChIKey is KVFWTEBBTQBYNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O3S/c1-3-11-8-12(13(16)18)15(21-11)17-14(19)9-4-6-10(20-2)7-5-9/h4-8H,3H2,1-2H3,(H2,16,18)(H,17,19).
What are the key properties of 5-ethyl-2-[(4-methoxybenzoyl)amino]thiophene-3-carboxamide?
5-ethyl-2-[(4-methoxybenzoyl)amino]thiophene-3-carboxamide has a molecular weight of 304.37 g/mol, XLogP of 2.67, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-2-[(4-methoxybenzoyl)amino]thiophene-3-carboxamide is sourced from PubChem (CID 842078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).