5-phenyl-2-[(2-piperidin-1-ylacetyl)amino]thiophene-3-carboxamide

C18H21N3O2S — CID 705195

IUPAC5-phenyl-2-[(2-piperidin-1-ylacetyl)amino]thiophene-3-carboxamide
SMILESNC(=O)c1cc(-c2ccccc2)sc1NC(=O)CN1CCCCC1
InChIInChI=1S/C18H21N3O2S/c19-17(23)14-11-15(13-7-3-1-4-8-13)24-18(14)20-16(22)12-21-9-5-2-6-10-21/h1,3-4,7-8,11H,2,5-6,9-10,12H2,(H2,19,23)(H,20,22)
InChIKeyUJRLZGIGEHBNPG-UHFFFAOYSA-N
MW343.45 g/mol
LogP2.94
Rot. Bonds5

About 5-phenyl-2-[(2-piperidin-1-ylacetyl)amino]thiophene-3-carboxamide

5-phenyl-2-[(2-piperidin-1-ylacetyl)amino]thiophene-3-carboxamide (PubChem CID 705195) has the molecular formula C18H21N3O2S and a molecular weight of 343.45 g/mol. Its IUPAC name is 5-phenyl-2-[(2-piperidin-1-ylacetyl)amino]thiophene-3-carboxamide.

Molecular Properties

Compound Name5-phenyl-2-[(2-piperidin-1-ylacetyl)amino]thiophene-3-carboxamide
PubChem CID705195
Molecular FormulaC18H21N3O2S
Molecular Weight343.45 g/mol
Exact Mass343.14
IUPAC Name5-phenyl-2-[(2-piperidin-1-ylacetyl)amino]thiophene-3-carboxamide
SMILESNC(=O)c1cc(-c2ccccc2)sc1NC(=O)CN1CCCCC1
InChIInChI=1S/C18H21N3O2S/c19-17(23)14-11-15(13-7-3-1-4-8-13)24-18(14)20-16(22)12-21-9-5-2-6-10-21/h1,3-4,7-8,11H,2,5-6,9-10,12H2,(H2,19,23)(H,20,22)
InChIKeyUJRLZGIGEHBNPG-UHFFFAOYSA-N
XLogP2.94
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.45
LogP ≤ 52.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-phenyl-2-[(2-piperidin-1-ylacetyl)amino]thiophene-3-carboxamide?
The IUPAC name of 5-phenyl-2-[(2-piperidin-1-ylacetyl)amino]thiophene-3-carboxamide (CID 705195) is 5-phenyl-2-[(2-piperidin-1-ylacetyl)amino]thiophene-3-carboxamide.
What is the SMILES notation for 5-phenyl-2-[(2-piperidin-1-ylacetyl)amino]thiophene-3-carboxamide?
The canonical SMILES for 5-phenyl-2-[(2-piperidin-1-ylacetyl)amino]thiophene-3-carboxamide is NC(=O)c1cc(-c2ccccc2)sc1NC(=O)CN1CCCCC1.
What is the InChIKey of 5-phenyl-2-[(2-piperidin-1-ylacetyl)amino]thiophene-3-carboxamide?
The InChIKey is UJRLZGIGEHBNPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O2S/c19-17(23)14-11-15(13-7-3-1-4-8-13)24-18(14)20-16(22)12-21-9-5-2-6-10-21/h1,3-4,7-8,11H,2,5-6,9-10,12H2,(H2,19,23)(H,20,22).
What are the key properties of 5-phenyl-2-[(2-piperidin-1-ylacetyl)amino]thiophene-3-carboxamide?
5-phenyl-2-[(2-piperidin-1-ylacetyl)amino]thiophene-3-carboxamide has a molecular weight of 343.45 g/mol, XLogP of 2.94, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-phenyl-2-[(2-piperidin-1-ylacetyl)amino]thiophene-3-carboxamide is sourced from PubChem (CID 705195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).