5-[2-(2-aminoethyl)piperidine-1-carbonyl]piperidin-2-one

C13H23N3O2 — CID 83192038

IUPAC5-[2-(2-aminoethyl)piperidine-1-carbonyl]piperidin-2-one
SMILESNCCC1CCCCN1C(=O)C1CCC(=O)NC1
InChIInChI=1S/C13H23N3O2/c14-7-6-11-3-1-2-8-16(11)13(18)10-4-5-12(17)15-9-10/h10-11H,1-9,14H2,(H,15,17)
InChIKeyGGIHJTNPOXMJRK-UHFFFAOYSA-N
MW253.35 g/mol
LogP0.24
Rot. Bonds3

About 5-[2-(2-aminoethyl)piperidine-1-carbonyl]piperidin-2-one

5-[2-(2-aminoethyl)piperidine-1-carbonyl]piperidin-2-one (PubChem CID 83192038) has the molecular formula C13H23N3O2 and a molecular weight of 253.35 g/mol. Its IUPAC name is 5-[2-(2-aminoethyl)piperidine-1-carbonyl]piperidin-2-one.

Molecular Properties

Compound Name5-[2-(2-aminoethyl)piperidine-1-carbonyl]piperidin-2-one
PubChem CID83192038
Molecular FormulaC13H23N3O2
Molecular Weight253.35 g/mol
Exact Mass253.18
IUPAC Name5-[2-(2-aminoethyl)piperidine-1-carbonyl]piperidin-2-one
SMILESNCCC1CCCCN1C(=O)C1CCC(=O)NC1
InChIInChI=1S/C13H23N3O2/c14-7-6-11-3-1-2-8-16(11)13(18)10-4-5-12(17)15-9-10/h10-11H,1-9,14H2,(H,15,17)
InChIKeyGGIHJTNPOXMJRK-UHFFFAOYSA-N
XLogP0.24
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.35
LogP ≤ 50.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[2-(2-hydroxyethyl)piperidine-1-carbonyl]pyrrolidin-2-one
CID 82705880
4-[2-(hydroxymethyl)azepane-1-carbonyl]pyrrolidin-2-one
CID 116636786
4-[(2S)-2-(pyrrolidin-1-ylmethyl)piperidine-1-carbonyl]pyrrolidin-2-one
CID 86268660
2-[1-(5-oxopyrrolidine-3-carbonyl)piperidin-2-yl]acetic acid
CID 83192498
[2-(2-aminoethyl)piperidin-1-yl]-cyclohexylmethanone
CID 63755194
(5S)-5-[(2R)-2-[[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]methyl]pyrrolidine-1-carbonyl]piperidin-2-one
CID 129377664
5-[4-(aminomethyl)piperidine-1-carbonyl]piperidin-2-one
CID 81470340
5-(azepane-1-carbonyl)piperidin-2-one
CID 112728735
5-(azocane-1-carbonyl)piperidin-2-one
CID 112728799
5-(2,3,4,4a,5,6,7,7a-octahydropyrrolo[3,4-b]pyridine-1-carbonyl)piperidin-2-one
CID 102679338
5-(2-phenylpyrrolidine-1-carbonyl)piperidin-2-one
CID 112728798
4-(2-cyclopentylpyrrolidine-1-carbonyl)pyrrolidin-2-one
CID 78983172

Frequently Asked Questions

What is the IUPAC name of 5-[2-(2-aminoethyl)piperidine-1-carbonyl]piperidin-2-one?
The IUPAC name of 5-[2-(2-aminoethyl)piperidine-1-carbonyl]piperidin-2-one (CID 83192038) is 5-[2-(2-aminoethyl)piperidine-1-carbonyl]piperidin-2-one.
What is the SMILES notation for 5-[2-(2-aminoethyl)piperidine-1-carbonyl]piperidin-2-one?
The canonical SMILES for 5-[2-(2-aminoethyl)piperidine-1-carbonyl]piperidin-2-one is NCCC1CCCCN1C(=O)C1CCC(=O)NC1.
What is the InChIKey of 5-[2-(2-aminoethyl)piperidine-1-carbonyl]piperidin-2-one?
The InChIKey is GGIHJTNPOXMJRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O2/c14-7-6-11-3-1-2-8-16(11)13(18)10-4-5-12(17)15-9-10/h10-11H,1-9,14H2,(H,15,17).
What are the key properties of 5-[2-(2-aminoethyl)piperidine-1-carbonyl]piperidin-2-one?
5-[2-(2-aminoethyl)piperidine-1-carbonyl]piperidin-2-one has a molecular weight of 253.35 g/mol, XLogP of 0.24, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(2-aminoethyl)piperidine-1-carbonyl]piperidin-2-one is sourced from PubChem (CID 83192038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).