1-(2-thiophen-3-ylacetyl)piperidine-4-carboxamide

C12H16N2O2S — CID 24685250

IUPAC1-(2-thiophen-3-ylacetyl)piperidine-4-carboxamide
SMILESNC(=O)C1CCN(C(=O)Cc2ccsc2)CC1
InChIInChI=1S/C12H16N2O2S/c13-12(16)10-1-4-14(5-2-10)11(15)7-9-3-6-17-8-9/h3,6,8,10H,1-2,4-5,7H2,(H2,13,16)
InChIKeyIIXCUVUCDPNLGK-UHFFFAOYSA-N
MW252.34 g/mol
LogP1.01
Rot. Bonds3

About 1-(2-thiophen-3-ylacetyl)piperidine-4-carboxamide

1-(2-thiophen-3-ylacetyl)piperidine-4-carboxamide (PubChem CID 24685250) has the molecular formula C12H16N2O2S and a molecular weight of 252.34 g/mol. Its IUPAC name is 1-(2-thiophen-3-ylacetyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(2-thiophen-3-ylacetyl)piperidine-4-carboxamide
PubChem CID24685250
Molecular FormulaC12H16N2O2S
Molecular Weight252.34 g/mol
Exact Mass252.09
IUPAC Name1-(2-thiophen-3-ylacetyl)piperidine-4-carboxamide
SMILESNC(=O)C1CCN(C(=O)Cc2ccsc2)CC1
InChIInChI=1S/C12H16N2O2S/c13-12(16)10-1-4-14(5-2-10)11(15)7-9-3-6-17-8-9/h3,6,8,10H,1-2,4-5,7H2,(H2,13,16)
InChIKeyIIXCUVUCDPNLGK-UHFFFAOYSA-N
XLogP1.01
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.34
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2-thiophen-3-ylacetyl)piperidine-4-carboxamide?
The IUPAC name of 1-(2-thiophen-3-ylacetyl)piperidine-4-carboxamide (CID 24685250) is 1-(2-thiophen-3-ylacetyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(2-thiophen-3-ylacetyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(2-thiophen-3-ylacetyl)piperidine-4-carboxamide is NC(=O)C1CCN(C(=O)Cc2ccsc2)CC1.
What is the InChIKey of 1-(2-thiophen-3-ylacetyl)piperidine-4-carboxamide?
The InChIKey is IIXCUVUCDPNLGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O2S/c13-12(16)10-1-4-14(5-2-10)11(15)7-9-3-6-17-8-9/h3,6,8,10H,1-2,4-5,7H2,(H2,13,16).
What are the key properties of 1-(2-thiophen-3-ylacetyl)piperidine-4-carboxamide?
1-(2-thiophen-3-ylacetyl)piperidine-4-carboxamide has a molecular weight of 252.34 g/mol, XLogP of 1.01, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-thiophen-3-ylacetyl)piperidine-4-carboxamide is sourced from PubChem (CID 24685250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).