1-(2-cyclopentylpyrrolidin-1-yl)-2-piperidin-4-yloxyethanone

C16H28N2O2 — CID 63876406

IUPAC1-(2-cyclopentylpyrrolidin-1-yl)-2-piperidin-4-yloxyethanone
SMILESO=C(COC1CCNCC1)N1CCCC1C1CCCC1
InChIInChI=1S/C16H28N2O2/c19-16(12-20-14-7-9-17-10-8-14)18-11-3-6-15(18)13-4-1-2-5-13/h13-15,17H,1-12H2
InChIKeyKSJFNTZMWWIABA-UHFFFAOYSA-N
MW280.41 g/mol
LogP1.94
Rot. Bonds4

About 1-(2-cyclopentylpyrrolidin-1-yl)-2-piperidin-4-yloxyethanone

1-(2-cyclopentylpyrrolidin-1-yl)-2-piperidin-4-yloxyethanone (PubChem CID 63876406) has the molecular formula C16H28N2O2 and a molecular weight of 280.41 g/mol. Its IUPAC name is 1-(2-cyclopentylpyrrolidin-1-yl)-2-piperidin-4-yloxyethanone.

Molecular Properties

Compound Name1-(2-cyclopentylpyrrolidin-1-yl)-2-piperidin-4-yloxyethanone
PubChem CID63876406
Molecular FormulaC16H28N2O2
Molecular Weight280.41 g/mol
Exact Mass280.22
IUPAC Name1-(2-cyclopentylpyrrolidin-1-yl)-2-piperidin-4-yloxyethanone
SMILESO=C(COC1CCNCC1)N1CCCC1C1CCCC1
InChIInChI=1S/C16H28N2O2/c19-16(12-20-14-7-9-17-10-8-14)18-11-3-6-15(18)13-4-1-2-5-13/h13-15,17H,1-12H2
InChIKeyKSJFNTZMWWIABA-UHFFFAOYSA-N
XLogP1.94
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.41
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-Piperidin-3-ylpyrrolidin-1-yl)-2-(2,2,2-trifluoroethoxy)ethanone
CID 103206915
1-(2-Piperidin-4-ylpyrrolidin-1-yl)-2-(2,2,2-trifluoroethoxy)ethanone
CID 103804928
1-(3-Pyrrolidin-2-ylpiperidin-1-yl)-2-(2,2,2-trifluoroethoxy)ethanone
CID 103832127
1-(4-Pyrrolidin-2-ylpiperidin-1-yl)-2-(2,2,2-trifluoroethoxy)ethanone
CID 103832243
N-[2-[(4aS,7aS)-4-(cyclopentylmethyl)-3-oxo-4a,5,7,7a-tetrahydropyrrolo[3,4-b][1,4]oxazin-6-yl]-2-oxoethyl]acetamide
CID 125238425
(4aS,7aS)-4-(cyclopentylmethyl)-5,6,7,7a-tetrahydro-4aH-pyrrolo[3,4-b][1,4]oxazin-3-one
CID 125252970
N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]-2-propan-2-yloxyacetamide
CID 48145337
N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]-2-propoxyacetamide
CID 48661988
2-Ethoxy-1-(3-pyrrolidin-2-ylpiperidin-1-yl)ethanone
CID 54885616
2-Ethoxy-1-(2-piperidin-3-ylpyrrolidin-1-yl)ethanone
CID 54885702
1,4-Dioxan-2-yl-(3-pyrrolidin-2-ylpiperidin-1-yl)methanone
CID 54885805
2-Ethoxy-1-(2-piperidin-4-ylpyrrolidin-1-yl)ethanone
CID 54886089

Frequently Asked Questions

What is the IUPAC name of 1-(2-cyclopentylpyrrolidin-1-yl)-2-piperidin-4-yloxyethanone?
The IUPAC name of 1-(2-cyclopentylpyrrolidin-1-yl)-2-piperidin-4-yloxyethanone (CID 63876406) is 1-(2-cyclopentylpyrrolidin-1-yl)-2-piperidin-4-yloxyethanone.
What is the SMILES notation for 1-(2-cyclopentylpyrrolidin-1-yl)-2-piperidin-4-yloxyethanone?
The canonical SMILES for 1-(2-cyclopentylpyrrolidin-1-yl)-2-piperidin-4-yloxyethanone is O=C(COC1CCNCC1)N1CCCC1C1CCCC1.
What is the InChIKey of 1-(2-cyclopentylpyrrolidin-1-yl)-2-piperidin-4-yloxyethanone?
The InChIKey is KSJFNTZMWWIABA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O2/c19-16(12-20-14-7-9-17-10-8-14)18-11-3-6-15(18)13-4-1-2-5-13/h13-15,17H,1-12H2.
What are the key properties of 1-(2-cyclopentylpyrrolidin-1-yl)-2-piperidin-4-yloxyethanone?
1-(2-cyclopentylpyrrolidin-1-yl)-2-piperidin-4-yloxyethanone has a molecular weight of 280.41 g/mol, XLogP of 1.94, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-cyclopentylpyrrolidin-1-yl)-2-piperidin-4-yloxyethanone is sourced from PubChem (CID 63876406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).