1-(3-piperidin-1-ylpropanoyl)piperidin-4-one

C13H22N2O2 — CID 123539984

IUPAC1-(3-piperidin-1-ylpropanoyl)piperidin-4-one
SMILESO=C1CCN(C(=O)CCN2CCCCC2)CC1
InChIInChI=1S/C13H22N2O2/c16-12-4-10-15(11-5-12)13(17)6-9-14-7-2-1-3-8-14/h1-11H2
InChIKeyFZCWENDSKNOKSJ-UHFFFAOYSA-N
MW238.33 g/mol
LogP1.05
Rot. Bonds3

About 1-(3-piperidin-1-ylpropanoyl)piperidin-4-one

1-(3-piperidin-1-ylpropanoyl)piperidin-4-one (PubChem CID 123539984) has the molecular formula C13H22N2O2 and a molecular weight of 238.33 g/mol. Its IUPAC name is 1-(3-piperidin-1-ylpropanoyl)piperidin-4-one.

Molecular Properties

Compound Name1-(3-piperidin-1-ylpropanoyl)piperidin-4-one
PubChem CID123539984
Molecular FormulaC13H22N2O2
Molecular Weight238.33 g/mol
Exact Mass238.17
IUPAC Name1-(3-piperidin-1-ylpropanoyl)piperidin-4-one
SMILESO=C1CCN(C(=O)CCN2CCCCC2)CC1
InChIInChI=1S/C13H22N2O2/c16-12-4-10-15(11-5-12)13(17)6-9-14-7-2-1-3-8-14/h1-11H2
InChIKeyFZCWENDSKNOKSJ-UHFFFAOYSA-N
XLogP1.05
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 51.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1,3-Bis(2-methylpiperidin-1-yl)propane-1,3-dione
CID 3407388
1,3-Di(piperidin-1-yl)propane-1,3-dione
CID 2334552
1,5-Di(piperidin-1-yl)pentan-3-one
CID 408697
1-[4-(3-Piperidin-1-ylpropyl)piperazin-1-yl]propan-1-one
CID 99714681
1-(3-Piperidinopropionyl)piperidine hydrochloride
CID 3030626
1,3-Di(piperidin-1-yl)propan-1-one
CID 3030627
1,4-Di(piperidin-1-yl)butane-1,4-dione
CID 3601995
1-(3-(1-Piperidinyl)propyl)-4-piperidone
CID 18001981
1-[4-(4-Oxopiperidin-1-yl)butyl]piperidin-4-one
CID 18700199
1,3-Di(piperidin-1-yl)propane-1,2,3-trione
CID 18719609
1-(4-Piperidin-1-ylpiperidin-1-yl)propan-1-one
CID 20782109
1-[2-(4-Methylpiperazin-1-yl)acetyl]piperidin-4-one
CID 43229278

Frequently Asked Questions

What is the IUPAC name of 1-(3-piperidin-1-ylpropanoyl)piperidin-4-one?
The IUPAC name of 1-(3-piperidin-1-ylpropanoyl)piperidin-4-one (CID 123539984) is 1-(3-piperidin-1-ylpropanoyl)piperidin-4-one.
What is the SMILES notation for 1-(3-piperidin-1-ylpropanoyl)piperidin-4-one?
The canonical SMILES for 1-(3-piperidin-1-ylpropanoyl)piperidin-4-one is O=C1CCN(C(=O)CCN2CCCCC2)CC1.
What is the InChIKey of 1-(3-piperidin-1-ylpropanoyl)piperidin-4-one?
The InChIKey is FZCWENDSKNOKSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O2/c16-12-4-10-15(11-5-12)13(17)6-9-14-7-2-1-3-8-14/h1-11H2.
What are the key properties of 1-(3-piperidin-1-ylpropanoyl)piperidin-4-one?
1-(3-piperidin-1-ylpropanoyl)piperidin-4-one has a molecular weight of 238.33 g/mol, XLogP of 1.05, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-piperidin-1-ylpropanoyl)piperidin-4-one is sourced from PubChem (CID 123539984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).