cyclopentyl 2-(8-azabicyclo[3.2.1]octan-3-yl)acetate

C14H23NO2 — CID 79609107

IUPACcyclopentyl 2-(8-azabicyclo[3.2.1]octan-3-yl)acetate
SMILESO=C(CC1CC2CCC(C1)N2)OC1CCCC1
InChIInChI=1S/C14H23NO2/c16-14(17-13-3-1-2-4-13)9-10-7-11-5-6-12(8-10)15-11/h10-13,15H,1-9H2
InChIKeyZCNJKGDDFYRPNT-UHFFFAOYSA-N
MW237.34 g/mol
LogP2.39
Rot. Bonds3

About cyclopentyl 2-(8-azabicyclo[3.2.1]octan-3-yl)acetate

cyclopentyl 2-(8-azabicyclo[3.2.1]octan-3-yl)acetate (PubChem CID 79609107) has the molecular formula C14H23NO2 and a molecular weight of 237.34 g/mol. Its IUPAC name is cyclopentyl 2-(8-azabicyclo[3.2.1]octan-3-yl)acetate.

Molecular Properties

Compound Namecyclopentyl 2-(8-azabicyclo[3.2.1]octan-3-yl)acetate
PubChem CID79609107
Molecular FormulaC14H23NO2
Molecular Weight237.34 g/mol
Exact Mass237.17
IUPAC Namecyclopentyl 2-(8-azabicyclo[3.2.1]octan-3-yl)acetate
SMILESO=C(CC1CC2CCC(C1)N2)OC1CCCC1
InChIInChI=1S/C14H23NO2/c16-14(17-13-3-1-2-4-13)9-10-7-11-5-6-12(8-10)15-11/h10-13,15H,1-9H2
InChIKeyZCNJKGDDFYRPNT-UHFFFAOYSA-N
XLogP2.39
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.34
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

cyclopentyl 2-cyclohexylacetate;hydrochloride
CID 174567498
cyclobutyl 2-piperidin-3-ylacetate
CID 62690484
oxolan-2-ylmethyl 2-(8-azabicyclo[3.2.1]octan-3-yl)acetate
CID 79609187
1-(8-azabicyclo[3.2.1]octan-3-yl)but-3-en-2-one
CID 116588306
cyclohexyl 2-pyrrolidin-2-ylacetate
CID 61372710
2-methylpentyl 2-(8-azabicyclo[3.2.1]octan-3-yl)acetate
CID 103284259
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(cyclopentylmethyl)-N-methylacetamide;hydrochloride
CID 119759233
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-cyclooctyl-N-methylacetamide;hydrochloride
CID 119763862
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(2-hydroxycyclohexyl)acetamide
CID 79615606
cyclopentyl 3-cyclopentylpropanoate
CID 534685
1-(8-azabicyclo[3.2.1]octan-3-yl)dodecan-2-one
CID 116588294
1-(8-azabicyclo[3.2.1]octan-3-yl)octan-2-one
CID 116588352

Frequently Asked Questions

What is the IUPAC name of cyclopentyl 2-(8-azabicyclo[3.2.1]octan-3-yl)acetate?
The IUPAC name of cyclopentyl 2-(8-azabicyclo[3.2.1]octan-3-yl)acetate (CID 79609107) is cyclopentyl 2-(8-azabicyclo[3.2.1]octan-3-yl)acetate.
What is the SMILES notation for cyclopentyl 2-(8-azabicyclo[3.2.1]octan-3-yl)acetate?
The canonical SMILES for cyclopentyl 2-(8-azabicyclo[3.2.1]octan-3-yl)acetate is O=C(CC1CC2CCC(C1)N2)OC1CCCC1.
What is the InChIKey of cyclopentyl 2-(8-azabicyclo[3.2.1]octan-3-yl)acetate?
The InChIKey is ZCNJKGDDFYRPNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO2/c16-14(17-13-3-1-2-4-13)9-10-7-11-5-6-12(8-10)15-11/h10-13,15H,1-9H2.
What are the key properties of cyclopentyl 2-(8-azabicyclo[3.2.1]octan-3-yl)acetate?
cyclopentyl 2-(8-azabicyclo[3.2.1]octan-3-yl)acetate has a molecular weight of 237.34 g/mol, XLogP of 2.39, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentyl 2-(8-azabicyclo[3.2.1]octan-3-yl)acetate is sourced from PubChem (CID 79609107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).