2-(4-aminopiperidin-1-yl)-1-(furan-2-yl)ethanone

C11H16N2O2 — CID 62031487

IUPAC2-(4-aminopiperidin-1-yl)-1-(furan-2-yl)ethanone
SMILESNC1CCN(CC(=O)c2ccco2)CC1
InChIInChI=1S/C11H16N2O2/c12-9-3-5-13(6-4-9)8-10(14)11-2-1-7-15-11/h1-2,7,9H,3-6,8,12H2
InChIKeyADRBYJYVWIQEDW-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.89
Rot. Bonds3

About 2-(4-aminopiperidin-1-yl)-1-(furan-2-yl)ethanone

2-(4-aminopiperidin-1-yl)-1-(furan-2-yl)ethanone (PubChem CID 62031487) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is 2-(4-aminopiperidin-1-yl)-1-(furan-2-yl)ethanone.

Molecular Properties

Compound Name2-(4-aminopiperidin-1-yl)-1-(furan-2-yl)ethanone
PubChem CID62031487
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC Name2-(4-aminopiperidin-1-yl)-1-(furan-2-yl)ethanone
SMILESNC1CCN(CC(=O)c2ccco2)CC1
InChIInChI=1S/C11H16N2O2/c12-9-3-5-13(6-4-9)8-10(14)11-2-1-7-15-11/h1-2,7,9H,3-6,8,12H2
InChIKeyADRBYJYVWIQEDW-UHFFFAOYSA-N
XLogP0.89
TPSA59.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-(aminomethyl)piperidin-1-yl]-1-(furan-2-yl)ethanone;hydrochloride
CID 71644820
2-[1-[2-(furan-2-yl)-2-oxoethyl]piperidin-4-yl]acetamide
CID 54989522
1-(furan-2-yl)-2-(4-propylpiperidin-1-yl)ethanone
CID 55050319
N-[2-(4-aminopiperidin-1-yl)acetyl]furan-2-carboxamide
CID 43556804
1-(furan-2-yl)-2-[4-(methoxymethyl)piperidin-1-yl]ethanone
CID 63971558
1-(furan-2-yl)-2-(3-hydroxy-4-methylpiperidin-1-yl)ethanone
CID 102960348
1-(furan-2-yl)-2-[4-(2-hydroxyethyl)piperazin-1-yl]ethanone
CID 62025348
1-(furan-2-yl)-2-[(3S)-3-(hydroxymethyl)piperidin-1-yl]ethanone
CID 94201565
1-(furan-2-yl)-2-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]ethanone
CID 55140385
2-(1,3-dihydroisoindol-2-yl)-1-(furan-2-yl)ethanone
CID 62206434
2-[[1-[2-(furan-2-yl)-2-oxoethyl]piperidin-4-yl]methyl]-3H-isoindol-1-one;hydrochloride
CID 21078000
2-[(4-aminocyclohexyl)amino]-1-(furan-2-yl)ethanone
CID 71643902

Frequently Asked Questions

What is the IUPAC name of 2-(4-aminopiperidin-1-yl)-1-(furan-2-yl)ethanone?
The IUPAC name of 2-(4-aminopiperidin-1-yl)-1-(furan-2-yl)ethanone (CID 62031487) is 2-(4-aminopiperidin-1-yl)-1-(furan-2-yl)ethanone.
What is the SMILES notation for 2-(4-aminopiperidin-1-yl)-1-(furan-2-yl)ethanone?
The canonical SMILES for 2-(4-aminopiperidin-1-yl)-1-(furan-2-yl)ethanone is NC1CCN(CC(=O)c2ccco2)CC1.
What is the InChIKey of 2-(4-aminopiperidin-1-yl)-1-(furan-2-yl)ethanone?
The InChIKey is ADRBYJYVWIQEDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c12-9-3-5-13(6-4-9)8-10(14)11-2-1-7-15-11/h1-2,7,9H,3-6,8,12H2.
What are the key properties of 2-(4-aminopiperidin-1-yl)-1-(furan-2-yl)ethanone?
2-(4-aminopiperidin-1-yl)-1-(furan-2-yl)ethanone has a molecular weight of 208.26 g/mol, XLogP of 0.89, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminopiperidin-1-yl)-1-(furan-2-yl)ethanone is sourced from PubChem (CID 62031487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).