5-acetyl-N-(2-piperidin-1-ylphenyl)thiophene-2-carboxamide

C18H20N2O2S — CID 11255926

IUPAC5-acetyl-N-(2-piperidin-1-ylphenyl)thiophene-2-carboxamide
SMILESCC(=O)c1ccc(C(=O)Nc2ccccc2N2CCCCC2)s1
InChIInChI=1S/C18H20N2O2S/c1-13(21)16-9-10-17(23-16)18(22)19-14-7-3-4-8-15(14)20-11-5-2-6-12-20/h3-4,7-10H,2,5-6,11-12H2,1H3,(H,19,22)
InChIKeyZLZOLLHPYUHXJX-UHFFFAOYSA-N
MW328.44 g/mol
LogP4.19
Rot. Bonds4

About 5-acetyl-N-(2-piperidin-1-ylphenyl)thiophene-2-carboxamide

5-acetyl-N-(2-piperidin-1-ylphenyl)thiophene-2-carboxamide (PubChem CID 11255926) has the molecular formula C18H20N2O2S and a molecular weight of 328.44 g/mol. Its IUPAC name is 5-acetyl-N-(2-piperidin-1-ylphenyl)thiophene-2-carboxamide.

Molecular Properties

Compound Name5-acetyl-N-(2-piperidin-1-ylphenyl)thiophene-2-carboxamide
PubChem CID11255926
Molecular FormulaC18H20N2O2S
Molecular Weight328.44 g/mol
Exact Mass328.12
IUPAC Name5-acetyl-N-(2-piperidin-1-ylphenyl)thiophene-2-carboxamide
SMILESCC(=O)c1ccc(C(=O)Nc2ccccc2N2CCCCC2)s1
InChIInChI=1S/C18H20N2O2S/c1-13(21)16-9-10-17(23-16)18(22)19-14-7-3-4-8-15(14)20-11-5-2-6-12-20/h3-4,7-10H,2,5-6,11-12H2,1H3,(H,19,22)
InChIKeyZLZOLLHPYUHXJX-UHFFFAOYSA-N
XLogP4.19
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.44
LogP ≤ 54.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4,5-dimethyl-N-(2-piperidin-1-ylphenyl)thiophene-2-carboxamide
CID 37172802
N-[2-(azepan-1-yl)phenyl]-2-methyl-1,3-thiazole-5-carboxamide
CID 71881060
N-[2-(azepan-1-yl)phenyl]benzamide
CID 24652732
3-methyl-N-(2-piperidin-1-ylphenyl)thiophene-2-carboxamide
CID 35728610
2-iodo-N-(2-piperidin-1-ylphenyl)benzamide
CID 1308785
4-amino-N-(2-piperidin-1-ylphenyl)benzamide
CID 119828017
N-(2-piperidin-1-ylphenyl)propanamide
CID 960826
2,2-difluoro-N-(2-piperidin-1-ylphenyl)acetamide
CID 103600704
3,5-dimethyl-N-(2-pyrrolidin-1-ylphenyl)benzamide
CID 7492197
5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-N-(2-piperidin-1-ylphenyl)thiophene-2-carboxamide
CID 74226495
N-[2-(azepan-1-yl)phenyl]-4-ethylbenzamide
CID 18267161
3-acetamido-N-[2-(azepan-1-yl)phenyl]-4-methylbenzamide
CID 86998079

Frequently Asked Questions

What is the IUPAC name of 5-acetyl-N-(2-piperidin-1-ylphenyl)thiophene-2-carboxamide?
The IUPAC name of 5-acetyl-N-(2-piperidin-1-ylphenyl)thiophene-2-carboxamide (CID 11255926) is 5-acetyl-N-(2-piperidin-1-ylphenyl)thiophene-2-carboxamide.
What is the SMILES notation for 5-acetyl-N-(2-piperidin-1-ylphenyl)thiophene-2-carboxamide?
The canonical SMILES for 5-acetyl-N-(2-piperidin-1-ylphenyl)thiophene-2-carboxamide is CC(=O)c1ccc(C(=O)Nc2ccccc2N2CCCCC2)s1.
What is the InChIKey of 5-acetyl-N-(2-piperidin-1-ylphenyl)thiophene-2-carboxamide?
The InChIKey is ZLZOLLHPYUHXJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O2S/c1-13(21)16-9-10-17(23-16)18(22)19-14-7-3-4-8-15(14)20-11-5-2-6-12-20/h3-4,7-10H,2,5-6,11-12H2,1H3,(H,19,22).
What are the key properties of 5-acetyl-N-(2-piperidin-1-ylphenyl)thiophene-2-carboxamide?
5-acetyl-N-(2-piperidin-1-ylphenyl)thiophene-2-carboxamide has a molecular weight of 328.44 g/mol, XLogP of 4.19, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-acetyl-N-(2-piperidin-1-ylphenyl)thiophene-2-carboxamide is sourced from PubChem (CID 11255926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).