3-amino-N-(2,6-diethylphenyl)thiophene-2-carboxamide

C15H18N2OS — CID 61091035

IUPAC3-amino-N-(2,6-diethylphenyl)thiophene-2-carboxamide
SMILESCCc1cccc(CC)c1NC(=O)c1sccc1N
InChIInChI=1S/C15H18N2OS/c1-3-10-6-5-7-11(4-2)13(10)17-15(18)14-12(16)8-9-19-14/h5-9H,3-4,16H2,1-2H3,(H,17,18)
InChIKeyXOJSXXVJUKZERU-UHFFFAOYSA-N
MW274.39 g/mol
LogP3.71
Rot. Bonds4

About 3-amino-N-(2,6-diethylphenyl)thiophene-2-carboxamide

3-amino-N-(2,6-diethylphenyl)thiophene-2-carboxamide (PubChem CID 61091035) has the molecular formula C15H18N2OS and a molecular weight of 274.39 g/mol. Its IUPAC name is 3-amino-N-(2,6-diethylphenyl)thiophene-2-carboxamide.

Molecular Properties

Compound Name3-amino-N-(2,6-diethylphenyl)thiophene-2-carboxamide
PubChem CID61091035
Molecular FormulaC15H18N2OS
Molecular Weight274.39 g/mol
Exact Mass274.11
IUPAC Name3-amino-N-(2,6-diethylphenyl)thiophene-2-carboxamide
SMILESCCc1cccc(CC)c1NC(=O)c1sccc1N
InChIInChI=1S/C15H18N2OS/c1-3-10-6-5-7-11(4-2)13(10)17-15(18)14-12(16)8-9-19-14/h5-9H,3-4,16H2,1-2H3,(H,17,18)
InChIKeyXOJSXXVJUKZERU-UHFFFAOYSA-N
XLogP3.71
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.39
LogP ≤ 53.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N-(2-ethylphenyl)thiophene-2-carboxamide
CID 61091897
3-amino-N-(4-ethylphenyl)thiophene-2-carboxamide
CID 61089660
3-amino-N-(2-bromo-6-fluorophenyl)thiophene-2-carboxamide
CID 107596209
N-(2,6-diethylphenyl)-4-methyl-2-thiophen-2-yl-1,3-thiazole-5-carboxamide
CID 27667865
2-amino-N-(2,6-diethylphenyl)-1,3-thiazole-4-carboxamide
CID 55115870
[2-(2,6-diethylanilino)-2-oxoethyl] 3-methylthiophene-2-carboxylate
CID 7837716
3-amino-N-(3-methoxyphenyl)thiophene-2-carboxamide
CID 61090375
4-amino-N-(2,6-diethylphenyl)-3-hydroxybenzamide
CID 107073824
3-amino-N-(3-propan-2-ylphenyl)thiophene-2-carboxamide
CID 61092976
N-(2-acetamidoethyl)-3-aminothiophene-2-carboxamide
CID 61092677
N-(2,6-diethylphenyl)-N'-(1,3-thiazol-2-yl)oxamide
CID 108511411
4-amino-N-(2,6-diethylphenyl)pyridine-3-carboxamide
CID 81235051

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2,6-diethylphenyl)thiophene-2-carboxamide?
The IUPAC name of 3-amino-N-(2,6-diethylphenyl)thiophene-2-carboxamide (CID 61091035) is 3-amino-N-(2,6-diethylphenyl)thiophene-2-carboxamide.
What is the SMILES notation for 3-amino-N-(2,6-diethylphenyl)thiophene-2-carboxamide?
The canonical SMILES for 3-amino-N-(2,6-diethylphenyl)thiophene-2-carboxamide is CCc1cccc(CC)c1NC(=O)c1sccc1N.
What is the InChIKey of 3-amino-N-(2,6-diethylphenyl)thiophene-2-carboxamide?
The InChIKey is XOJSXXVJUKZERU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2OS/c1-3-10-6-5-7-11(4-2)13(10)17-15(18)14-12(16)8-9-19-14/h5-9H,3-4,16H2,1-2H3,(H,17,18).
What are the key properties of 3-amino-N-(2,6-diethylphenyl)thiophene-2-carboxamide?
3-amino-N-(2,6-diethylphenyl)thiophene-2-carboxamide has a molecular weight of 274.39 g/mol, XLogP of 3.71, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2,6-diethylphenyl)thiophene-2-carboxamide is sourced from PubChem (CID 61091035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).