2-amino-1-(4-thiophen-2-ylpiperidin-1-yl)ethanone

C11H16N2OS — CID 82128116

IUPAC2-amino-1-(4-thiophen-2-ylpiperidin-1-yl)ethanone
SMILESNCC(=O)N1CCC(c2cccs2)CC1
InChIInChI=1S/C11H16N2OS/c12-8-11(14)13-5-3-9(4-6-13)10-2-1-7-15-10/h1-2,7,9H,3-6,8,12H2
InChIKeyRJZPMONTGAXYEW-UHFFFAOYSA-N
MW224.33 g/mol
LogP1.41
Rot. Bonds2

About 2-amino-1-(4-thiophen-2-ylpiperidin-1-yl)ethanone

2-amino-1-(4-thiophen-2-ylpiperidin-1-yl)ethanone (PubChem CID 82128116) has the molecular formula C11H16N2OS and a molecular weight of 224.33 g/mol. Its IUPAC name is 2-amino-1-(4-thiophen-2-ylpiperidin-1-yl)ethanone.

Molecular Properties

Compound Name2-amino-1-(4-thiophen-2-ylpiperidin-1-yl)ethanone
PubChem CID82128116
Molecular FormulaC11H16N2OS
Molecular Weight224.33 g/mol
Exact Mass224.10
IUPAC Name2-amino-1-(4-thiophen-2-ylpiperidin-1-yl)ethanone
SMILESNCC(=O)N1CCC(c2cccs2)CC1
InChIInChI=1S/C11H16N2OS/c12-8-11(14)13-5-3-9(4-6-13)10-2-1-7-15-10/h1-2,7,9H,3-6,8,12H2
InChIKeyRJZPMONTGAXYEW-UHFFFAOYSA-N
XLogP1.41
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.33
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-1-(4-thiophen-2-ylpiperidin-1-yl)ethanone
CID 82130314
4-oxo-4-(4-thiophen-2-ylpiperidin-1-yl)butanoic acid
CID 82134002
hydroxymethyl 3-thiophen-2-ylpyrrolidine-1-carboxylate
CID 154081566
3-(4-methoxyphenyl)-1-(4-thiophen-2-ylpiperidin-1-yl)propan-1-one
CID 90522107
(E)-3-phenyl-1-(4-thiophen-2-ylpiperidin-1-yl)prop-2-en-1-one
CID 71786847
3-[2-oxo-2-(4-thiophen-2-ylpiperidin-1-yl)ethyl]-1,3-benzoxazol-2-one
CID 71786887
thiophen-3-yl-(4-thiophen-2-ylpiperidin-1-yl)methanone
CID 71786843
4-thiophen-2-ylpiperidine-1-carbaldehyde
CID 89385438
4-amino-1-(2-thiophen-2-ylpyrrolidin-1-yl)butan-1-one
CID 60937933
(2-methylphenyl)-(4-thiophen-2-ylpiperidin-1-yl)methanone
CID 71786844
N-(2-methoxyethyl)-4-thiophen-2-ylpiperidine-1-carboxamide
CID 71786930
3-thiophen-3-yl-1-(4-thiophen-2-ylpiperidin-1-yl)prop-2-en-1-one
CID 71960797

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-(4-thiophen-2-ylpiperidin-1-yl)ethanone?
The IUPAC name of 2-amino-1-(4-thiophen-2-ylpiperidin-1-yl)ethanone (CID 82128116) is 2-amino-1-(4-thiophen-2-ylpiperidin-1-yl)ethanone.
What is the SMILES notation for 2-amino-1-(4-thiophen-2-ylpiperidin-1-yl)ethanone?
The canonical SMILES for 2-amino-1-(4-thiophen-2-ylpiperidin-1-yl)ethanone is NCC(=O)N1CCC(c2cccs2)CC1.
What is the InChIKey of 2-amino-1-(4-thiophen-2-ylpiperidin-1-yl)ethanone?
The InChIKey is RJZPMONTGAXYEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2OS/c12-8-11(14)13-5-3-9(4-6-13)10-2-1-7-15-10/h1-2,7,9H,3-6,8,12H2.
What are the key properties of 2-amino-1-(4-thiophen-2-ylpiperidin-1-yl)ethanone?
2-amino-1-(4-thiophen-2-ylpiperidin-1-yl)ethanone has a molecular weight of 224.33 g/mol, XLogP of 1.41, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-(4-thiophen-2-ylpiperidin-1-yl)ethanone is sourced from PubChem (CID 82128116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).