4-amino-6-thiophen-2-ylpiperidin-2-one

C9H12N2OS — CID 83818747

IUPAC4-amino-6-thiophen-2-ylpiperidin-2-one
SMILESNC1CC(=O)NC(c2cccs2)C1
InChIInChI=1S/C9H12N2OS/c10-6-4-7(11-9(12)5-6)8-2-1-3-13-8/h1-3,6-7H,4-5,10H2,(H,11,12)
InChIKeyZUOJFCNEXLXOCO-UHFFFAOYSA-N
MW196.28 g/mol
LogP1.03
Rot. Bonds1

About 4-amino-6-thiophen-2-ylpiperidin-2-one

4-amino-6-thiophen-2-ylpiperidin-2-one (PubChem CID 83818747) has the molecular formula C9H12N2OS and a molecular weight of 196.28 g/mol. Its IUPAC name is 4-amino-6-thiophen-2-ylpiperidin-2-one.

Molecular Properties

Compound Name4-amino-6-thiophen-2-ylpiperidin-2-one
PubChem CID83818747
Molecular FormulaC9H12N2OS
Molecular Weight196.28 g/mol
Exact Mass196.07
IUPAC Name4-amino-6-thiophen-2-ylpiperidin-2-one
SMILESNC1CC(=O)NC(c2cccs2)C1
InChIInChI=1S/C9H12N2OS/c10-6-4-7(11-9(12)5-6)8-2-1-3-13-8/h1-3,6-7H,4-5,10H2,(H,11,12)
InChIKeyZUOJFCNEXLXOCO-UHFFFAOYSA-N
XLogP1.03
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.28
LogP ≤ 51.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 126971724
4-amino-6-(3-methylphenyl)piperidin-2-one
CID 83819738
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CID 55263035
1,4-dithiophen-2-yl-1,2,4,5-tetrahydropyrrolo[3,4-c]pyrrole-3,6-dione
CID 77153151
(2S,3S)-5-oxo-2-thiophen-2-ylpyrrolidine-3-carboxylic acid
CID 82394638
cis-(1R,2S)-2-thiophen-2-ylcyclopropan-1-amine
CID 28901769
2-methyl-6-thiophen-2-ylpiperidin-3-amine
CID 165483665
3-thiophen-2-ylpyrrolidine-2,5-dione
CID 67512850
(2S)-2-thiophen-2-ylpiperidine
CID 7022116
5-benzyl-4-thiophen-2-ylpyrrolidin-2-one
CID 66104822
7-methyl-2-thiophen-2-yl-2,3-dihydro-1H-indole
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CID 170906424

Frequently Asked Questions

What is the IUPAC name of 4-amino-6-thiophen-2-ylpiperidin-2-one?
The IUPAC name of 4-amino-6-thiophen-2-ylpiperidin-2-one (CID 83818747) is 4-amino-6-thiophen-2-ylpiperidin-2-one.
What is the SMILES notation for 4-amino-6-thiophen-2-ylpiperidin-2-one?
The canonical SMILES for 4-amino-6-thiophen-2-ylpiperidin-2-one is NC1CC(=O)NC(c2cccs2)C1.
What is the InChIKey of 4-amino-6-thiophen-2-ylpiperidin-2-one?
The InChIKey is ZUOJFCNEXLXOCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2OS/c10-6-4-7(11-9(12)5-6)8-2-1-3-13-8/h1-3,6-7H,4-5,10H2,(H,11,12).
What are the key properties of 4-amino-6-thiophen-2-ylpiperidin-2-one?
4-amino-6-thiophen-2-ylpiperidin-2-one has a molecular weight of 196.28 g/mol, XLogP of 1.03, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-6-thiophen-2-ylpiperidin-2-one is sourced from PubChem (CID 83818747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).