1-morpholin-4-yl-2-(2-piperidin-4-ylpyrrolidin-1-yl)ethanone

C15H27N3O2 — CID 66271526

IUPAC1-morpholin-4-yl-2-(2-piperidin-4-ylpyrrolidin-1-yl)ethanone
SMILESO=C(CN1CCCC1C1CCNCC1)N1CCOCC1
InChIInChI=1S/C15H27N3O2/c19-15(17-8-10-20-11-9-17)12-18-7-1-2-14(18)13-3-5-16-6-4-13/h13-14,16H,1-12H2
InChIKeyNDWDWYHGKNPMBJ-UHFFFAOYSA-N
MW281.40 g/mol
LogP0.31
Rot. Bonds3

About 1-morpholin-4-yl-2-(2-piperidin-4-ylpyrrolidin-1-yl)ethanone

1-morpholin-4-yl-2-(2-piperidin-4-ylpyrrolidin-1-yl)ethanone (PubChem CID 66271526) has the molecular formula C15H27N3O2 and a molecular weight of 281.40 g/mol. Its IUPAC name is 1-morpholin-4-yl-2-(2-piperidin-4-ylpyrrolidin-1-yl)ethanone.

Molecular Properties

Compound Name1-morpholin-4-yl-2-(2-piperidin-4-ylpyrrolidin-1-yl)ethanone
PubChem CID66271526
Molecular FormulaC15H27N3O2
Molecular Weight281.40 g/mol
Exact Mass281.21
IUPAC Name1-morpholin-4-yl-2-(2-piperidin-4-ylpyrrolidin-1-yl)ethanone
SMILESO=C(CN1CCCC1C1CCNCC1)N1CCOCC1
InChIInChI=1S/C15H27N3O2/c19-15(17-8-10-20-11-9-17)12-18-7-1-2-14(18)13-3-5-16-6-4-13/h13-14,16H,1-12H2
InChIKeyNDWDWYHGKNPMBJ-UHFFFAOYSA-N
XLogP0.31
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 50.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-morpholin-4-yl-2-(2-piperidin-4-ylpyrrolidin-1-yl)ethanone?
The IUPAC name of 1-morpholin-4-yl-2-(2-piperidin-4-ylpyrrolidin-1-yl)ethanone (CID 66271526) is 1-morpholin-4-yl-2-(2-piperidin-4-ylpyrrolidin-1-yl)ethanone.
What is the SMILES notation for 1-morpholin-4-yl-2-(2-piperidin-4-ylpyrrolidin-1-yl)ethanone?
The canonical SMILES for 1-morpholin-4-yl-2-(2-piperidin-4-ylpyrrolidin-1-yl)ethanone is O=C(CN1CCCC1C1CCNCC1)N1CCOCC1.
What is the InChIKey of 1-morpholin-4-yl-2-(2-piperidin-4-ylpyrrolidin-1-yl)ethanone?
The InChIKey is NDWDWYHGKNPMBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O2/c19-15(17-8-10-20-11-9-17)12-18-7-1-2-14(18)13-3-5-16-6-4-13/h13-14,16H,1-12H2.
What are the key properties of 1-morpholin-4-yl-2-(2-piperidin-4-ylpyrrolidin-1-yl)ethanone?
1-morpholin-4-yl-2-(2-piperidin-4-ylpyrrolidin-1-yl)ethanone has a molecular weight of 281.40 g/mol, XLogP of 0.31, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-morpholin-4-yl-2-(2-piperidin-4-ylpyrrolidin-1-yl)ethanone is sourced from PubChem (CID 66271526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).