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

C12H16N2O2S — CID 94164984

IUPAC(3R)-1-(2-thiophen-3-ylacetyl)piperidine-3-carboxamide
SMILESNC(=O)[C@@H]1CCCN(C(=O)Cc2ccsc2)C1
InChIInChI=1S/C12H16N2O2S/c13-12(16)10-2-1-4-14(7-10)11(15)6-9-3-5-17-8-9/h3,5,8,10H,1-2,4,6-7H2,(H2,13,16)/t10-/m1/s1
InChIKeyZECAGGNKWBQSNM-SNVBAGLBSA-N
MW252.34 g/mol
LogP1.01
Rot. Bonds3

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

(3R)-1-(2-thiophen-3-ylacetyl)piperidine-3-carboxamide (PubChem CID 94164984) has the molecular formula C12H16N2O2S and a molecular weight of 252.34 g/mol. Its IUPAC name is (3R)-1-(2-thiophen-3-ylacetyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name(3R)-1-(2-thiophen-3-ylacetyl)piperidine-3-carboxamide
PubChem CID94164984
Molecular FormulaC12H16N2O2S
Molecular Weight252.34 g/mol
Exact Mass252.09
IUPAC Name(3R)-1-(2-thiophen-3-ylacetyl)piperidine-3-carboxamide
SMILESNC(=O)[C@@H]1CCCN(C(=O)Cc2ccsc2)C1
InChIInChI=1S/C12H16N2O2S/c13-12(16)10-2-1-4-14(7-10)11(15)6-9-3-5-17-8-9/h3,5,8,10H,1-2,4,6-7H2,(H2,13,16)/t10-/m1/s1
InChIKeyZECAGGNKWBQSNM-SNVBAGLBSA-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

Analyze (3R)-1-(2-thiophen-3-ylacetyl)piperidine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N'-hydroxy-1-(2-thiophen-3-ylacetyl)piperidine-3-carboximidamide
CID 77041855
1-(azocan-1-yl)-2-thiophen-3-ylethanone
CID 112769654
1-[(3S)-3-hydroxypiperidin-1-yl]-2-thiophen-3-ylethanone
CID 71649381
1-[1-(2-thiophen-3-ylacetyl)azetidin-3-yl]piperidine-4-carboxamide
CID 121154068
1-[(3R)-3-(pyrrolidin-1-ylmethyl)piperidin-1-yl]-2-thiophen-3-ylethanone
CID 29181741
1-[3-(1-methylimidazole-2-carbonyl)piperidin-1-yl]-2-thiophen-3-ylethanone
CID 70736283
1-[3-(methylaminomethyl)piperidin-1-yl]-2-thiophen-3-ylethanone
CID 61205444
(3S)-1-[2-(3,4-dichlorophenyl)acetyl]piperidine-3-carboxamide
CID 94164959
(3S)-1-(3-thiophen-3-ylpropanoyl)piperidine-3-carboxylic acid
CID 119173609
(3S,6R)-6-methyl-1-(2-thiophen-3-ylacetyl)piperidine-3-carboxamide
CID 94200571
1-[3-(4-chlorophenyl)azepan-1-yl]-2-thiophen-3-ylethanone
CID 121146683
1-[(3R)-3-(hydroxymethyl)pyrrolidin-1-yl]-2-thiophen-3-ylethanone
CID 94407469

Frequently Asked Questions

What is the IUPAC name of (3R)-1-(2-thiophen-3-ylacetyl)piperidine-3-carboxamide?
The IUPAC name of (3R)-1-(2-thiophen-3-ylacetyl)piperidine-3-carboxamide (CID 94164984) is (3R)-1-(2-thiophen-3-ylacetyl)piperidine-3-carboxamide.
What is the SMILES notation for (3R)-1-(2-thiophen-3-ylacetyl)piperidine-3-carboxamide?
The canonical SMILES for (3R)-1-(2-thiophen-3-ylacetyl)piperidine-3-carboxamide is NC(=O)[C@@H]1CCCN(C(=O)Cc2ccsc2)C1.
What is the InChIKey of (3R)-1-(2-thiophen-3-ylacetyl)piperidine-3-carboxamide?
The InChIKey is ZECAGGNKWBQSNM-SNVBAGLBSA-N. The full InChI is InChI=1S/C12H16N2O2S/c13-12(16)10-2-1-4-14(7-10)11(15)6-9-3-5-17-8-9/h3,5,8,10H,1-2,4,6-7H2,(H2,13,16)/t10-/m1/s1.
What are the key properties of (3R)-1-(2-thiophen-3-ylacetyl)piperidine-3-carboxamide?
(3R)-1-(2-thiophen-3-ylacetyl)piperidine-3-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 (3R)-1-(2-thiophen-3-ylacetyl)piperidine-3-carboxamide is sourced from PubChem (CID 94164984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).