1-cyclopentyl-2-pyrrolidin-2-ylethanone

C11H19NO — CID 79538692

IUPAC1-cyclopentyl-2-pyrrolidin-2-ylethanone
SMILESO=C(CC1CCCN1)C1CCCC1
InChIInChI=1S/C11H19NO/c13-11(9-4-1-2-5-9)8-10-6-3-7-12-10/h9-10,12H,1-8H2
InChIKeyWGDIQWDOMSEMST-UHFFFAOYSA-N
MW181.28 g/mol
LogP1.89
Rot. Bonds3

About 1-cyclopentyl-2-pyrrolidin-2-ylethanone

1-cyclopentyl-2-pyrrolidin-2-ylethanone (PubChem CID 79538692) has the molecular formula C11H19NO and a molecular weight of 181.28 g/mol. Its IUPAC name is 1-cyclopentyl-2-pyrrolidin-2-ylethanone.

Molecular Properties

Compound Name1-cyclopentyl-2-pyrrolidin-2-ylethanone
PubChem CID79538692
Molecular FormulaC11H19NO
Molecular Weight181.28 g/mol
Exact Mass181.15
IUPAC Name1-cyclopentyl-2-pyrrolidin-2-ylethanone
SMILESO=C(CC1CCCN1)C1CCCC1
InChIInChI=1S/C11H19NO/c13-11(9-4-1-2-5-9)8-10-6-3-7-12-10/h9-10,12H,1-8H2
InChIKeyWGDIQWDOMSEMST-UHFFFAOYSA-N
XLogP1.89
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.28
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-pyrrolidin-2-ylpropan-2-one
CID 45085262
1-hydroxy-3-pyrrolidin-2-ylpropan-2-one
CID 123192463
2-[(2R)-azepan-2-yl]acetic acid
CID 96634576
1-piperidin-2-ylbut-3-yn-2-one
CID 165465435
N-[2-[(2R)-pyrrolidin-2-yl]ethyl]cyclopentanecarboxamide
CID 104972065
1-amino-3-[(2R)-pyrrolidin-2-yl]propan-2-one
CID 54308072
1-[(2R)-azepan-2-yl]propan-2-one
CID 97048950
2-[(2S)-piperidin-2-yl]-1-pyrrolidin-1-ylethanone
CID 29083930
1-(azocan-1-yl)-2-pyrrolidin-2-ylethanone
CID 61372180
2-(azepan-2-yl)-1-(oxolan-2-yl)ethanone
CID 130577628
N-methyl-2-[(2S)-pyrrolidin-2-yl]acetamide
CID 66778094
N-methyl-2-[(2R)-pyrrolidin-2-yl]acetamide
CID 66776546

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-2-pyrrolidin-2-ylethanone?
The IUPAC name of 1-cyclopentyl-2-pyrrolidin-2-ylethanone (CID 79538692) is 1-cyclopentyl-2-pyrrolidin-2-ylethanone.
What is the SMILES notation for 1-cyclopentyl-2-pyrrolidin-2-ylethanone?
The canonical SMILES for 1-cyclopentyl-2-pyrrolidin-2-ylethanone is O=C(CC1CCCN1)C1CCCC1.
What is the InChIKey of 1-cyclopentyl-2-pyrrolidin-2-ylethanone?
The InChIKey is WGDIQWDOMSEMST-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO/c13-11(9-4-1-2-5-9)8-10-6-3-7-12-10/h9-10,12H,1-8H2.
What are the key properties of 1-cyclopentyl-2-pyrrolidin-2-ylethanone?
1-cyclopentyl-2-pyrrolidin-2-ylethanone has a molecular weight of 181.28 g/mol, XLogP of 1.89, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-2-pyrrolidin-2-ylethanone is sourced from PubChem (CID 79538692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).