5-(3-piperidin-1-ylpyrrolidine-1-carbonyl)piperazin-2-one

C14H24N4O2 — CID 107436462

IUPAC5-(3-piperidin-1-ylpyrrolidine-1-carbonyl)piperazin-2-one
SMILESO=C1CNC(C(=O)N2CCC(N3CCCCC3)C2)CN1
InChIInChI=1S/C14H24N4O2/c19-13-9-15-12(8-16-13)14(20)18-7-4-11(10-18)17-5-2-1-3-6-17/h11-12,15H,1-10H2,(H,16,19)
InChIKeyADTCVUBJEAQTGK-UHFFFAOYSA-N
MW280.37 g/mol
LogP-0.84
Rot. Bonds2

About 5-(3-piperidin-1-ylpyrrolidine-1-carbonyl)piperazin-2-one

5-(3-piperidin-1-ylpyrrolidine-1-carbonyl)piperazin-2-one (PubChem CID 107436462) has the molecular formula C14H24N4O2 and a molecular weight of 280.37 g/mol. Its IUPAC name is 5-(3-piperidin-1-ylpyrrolidine-1-carbonyl)piperazin-2-one.

Molecular Properties

Compound Name5-(3-piperidin-1-ylpyrrolidine-1-carbonyl)piperazin-2-one
PubChem CID107436462
Molecular FormulaC14H24N4O2
Molecular Weight280.37 g/mol
Exact Mass280.19
IUPAC Name5-(3-piperidin-1-ylpyrrolidine-1-carbonyl)piperazin-2-one
SMILESO=C1CNC(C(=O)N2CCC(N3CCCCC3)C2)CN1
InChIInChI=1S/C14H24N4O2/c19-13-9-15-12(8-16-13)14(20)18-7-4-11(10-18)17-5-2-1-3-6-17/h11-12,15H,1-10H2,(H,16,19)
InChIKeyADTCVUBJEAQTGK-UHFFFAOYSA-N
XLogP-0.84
TPSA64.68 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 5-0.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(5-oxopiperazine-2-carbonyl)pyrrolidine-3-carboxamide
CID 114081877
5-(azetidine-1-carbonyl)piperazin-2-one
CID 126980518
(4-hydroxypyrrolidin-2-yl)-(3-piperidin-1-ylpyrrolidin-1-yl)methanone;dihydrochloride
CID 119877822
5-(4-tert-butylazepane-1-carbonyl)piperazin-2-one
CID 107436688
(4-methoxypyrrolidin-2-yl)-(3-piperidin-1-ylpyrrolidin-1-yl)methanone
CID 63167377
5-(3,6-dihydro-2H-pyridine-1-carbonyl)piperazin-2-one
CID 107437768
(3-piperidin-1-ylpyrrolidin-1-yl)-pyrrolidin-3-ylmethanone;dihydrochloride
CID 119877849
3-[1-(5-oxopiperazine-2-carbonyl)piperidin-3-yl]butanoic acid
CID 107437161
2-methyl-N-[1-(5-oxopiperazine-2-carbonyl)piperidin-4-yl]propanamide
CID 107435207
pyrrolidin-3-yl-(3-pyrrolidin-1-ylpyrrolidin-1-yl)methanone
CID 63167029
[(2S,4S)-4-hydroxypyrrolidin-2-yl]-[(3S)-3-pyrrolidin-1-ylpiperidin-1-yl]methanone
CID 93375850
methyl 2-[4-(5-oxopiperazine-2-carbonyl)piperazin-1-yl]acetate
CID 107435401

Frequently Asked Questions

What is the IUPAC name of 5-(3-piperidin-1-ylpyrrolidine-1-carbonyl)piperazin-2-one?
The IUPAC name of 5-(3-piperidin-1-ylpyrrolidine-1-carbonyl)piperazin-2-one (CID 107436462) is 5-(3-piperidin-1-ylpyrrolidine-1-carbonyl)piperazin-2-one.
What is the SMILES notation for 5-(3-piperidin-1-ylpyrrolidine-1-carbonyl)piperazin-2-one?
The canonical SMILES for 5-(3-piperidin-1-ylpyrrolidine-1-carbonyl)piperazin-2-one is O=C1CNC(C(=O)N2CCC(N3CCCCC3)C2)CN1.
What is the InChIKey of 5-(3-piperidin-1-ylpyrrolidine-1-carbonyl)piperazin-2-one?
The InChIKey is ADTCVUBJEAQTGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O2/c19-13-9-15-12(8-16-13)14(20)18-7-4-11(10-18)17-5-2-1-3-6-17/h11-12,15H,1-10H2,(H,16,19).
What are the key properties of 5-(3-piperidin-1-ylpyrrolidine-1-carbonyl)piperazin-2-one?
5-(3-piperidin-1-ylpyrrolidine-1-carbonyl)piperazin-2-one has a molecular weight of 280.37 g/mol, XLogP of -0.84, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-piperidin-1-ylpyrrolidine-1-carbonyl)piperazin-2-one is sourced from PubChem (CID 107436462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).