cyclopentylmethyl 2-pyrrolidin-2-ylacetate

C12H21NO2 — CID 66323077

IUPACcyclopentylmethyl 2-pyrrolidin-2-ylacetate
SMILESO=C(CC1CCCN1)OCC1CCCC1
InChIInChI=1S/C12H21NO2/c14-12(8-11-6-3-7-13-11)15-9-10-4-1-2-5-10/h10-11,13H,1-9H2
InChIKeySIQNPPDJSVDOBF-UHFFFAOYSA-N
MW211.30 g/mol
LogP1.86
Rot. Bonds4

About cyclopentylmethyl 2-pyrrolidin-2-ylacetate

cyclopentylmethyl 2-pyrrolidin-2-ylacetate (PubChem CID 66323077) has the molecular formula C12H21NO2 and a molecular weight of 211.30 g/mol. Its IUPAC name is cyclopentylmethyl 2-pyrrolidin-2-ylacetate.

Molecular Properties

Compound Namecyclopentylmethyl 2-pyrrolidin-2-ylacetate
PubChem CID66323077
Molecular FormulaC12H21NO2
Molecular Weight211.30 g/mol
Exact Mass211.16
IUPAC Namecyclopentylmethyl 2-pyrrolidin-2-ylacetate
SMILESO=C(CC1CCCN1)OCC1CCCC1
InChIInChI=1S/C12H21NO2/c14-12(8-11-6-3-7-13-11)15-9-10-4-1-2-5-10/h10-11,13H,1-9H2
InChIKeySIQNPPDJSVDOBF-UHFFFAOYSA-N
XLogP1.86
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.30
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

cyclohexyl 2-pyrrolidin-2-ylacetate
CID 61372710
N-(cyclopentylmethyl)-2-pyrrolidin-2-ylacetamide
CID 61370022
cyclopropylmethyl 2-thiomorpholin-3-ylacetate
CID 66445671
methyl 2-(azocan-2-yl)acetate
CID 86040521
ethane;methyl 2-piperidin-2-ylacetate
CID 168986004
N-(cyclobutylmethyl)-2-pyrrolidin-2-ylacetamide
CID 61372732
1-amino-3-[(2R)-pyrrolidin-2-yl]propan-2-one
CID 54308072
1-cyclopentyl-2-pyrrolidin-2-ylethanone
CID 79538692
2-(cyclohexylmethoxymethyl)pyrrolidine
CID 62335288
cyclopropylmethyl (2S)-piperidine-2-carboxylate
CID 66262951
1-pyrrolidin-2-ylpropan-2-one
CID 45085262
(3-chlorophenyl)methyl 2-pyrrolidin-2-ylacetate
CID 65127484

Frequently Asked Questions

What is the IUPAC name of cyclopentylmethyl 2-pyrrolidin-2-ylacetate?
The IUPAC name of cyclopentylmethyl 2-pyrrolidin-2-ylacetate (CID 66323077) is cyclopentylmethyl 2-pyrrolidin-2-ylacetate.
What is the SMILES notation for cyclopentylmethyl 2-pyrrolidin-2-ylacetate?
The canonical SMILES for cyclopentylmethyl 2-pyrrolidin-2-ylacetate is O=C(CC1CCCN1)OCC1CCCC1.
What is the InChIKey of cyclopentylmethyl 2-pyrrolidin-2-ylacetate?
The InChIKey is SIQNPPDJSVDOBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21NO2/c14-12(8-11-6-3-7-13-11)15-9-10-4-1-2-5-10/h10-11,13H,1-9H2.
What are the key properties of cyclopentylmethyl 2-pyrrolidin-2-ylacetate?
cyclopentylmethyl 2-pyrrolidin-2-ylacetate has a molecular weight of 211.30 g/mol, XLogP of 1.86, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentylmethyl 2-pyrrolidin-2-ylacetate is sourced from PubChem (CID 66323077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).