1-(1-cyclopentyl-2,2-dimethylpyrrolidin-3-yl)piperazine

C15H29N3 — CID 117017868

IUPAC1-(1-cyclopentyl-2,2-dimethylpyrrolidin-3-yl)piperazine
SMILESCC1(C)C(N2CCNCC2)CCN1C1CCCC1
InChIInChI=1S/C15H29N3/c1-15(2)14(17-11-8-16-9-12-17)7-10-18(15)13-5-3-4-6-13/h13-14,16H,3-12H2,1-2H3
InChIKeyODAKXKQMYOUABH-UHFFFAOYSA-N
MW251.42 g/mol
LogP1.69
Rot. Bonds2

About 1-(1-cyclopentyl-2,2-dimethylpyrrolidin-3-yl)piperazine

1-(1-cyclopentyl-2,2-dimethylpyrrolidin-3-yl)piperazine (PubChem CID 117017868) has the molecular formula C15H29N3 and a molecular weight of 251.42 g/mol. Its IUPAC name is 1-(1-cyclopentyl-2,2-dimethylpyrrolidin-3-yl)piperazine.

Molecular Properties

Compound Name1-(1-cyclopentyl-2,2-dimethylpyrrolidin-3-yl)piperazine
PubChem CID117017868
Molecular FormulaC15H29N3
Molecular Weight251.42 g/mol
Exact Mass251.24
IUPAC Name1-(1-cyclopentyl-2,2-dimethylpyrrolidin-3-yl)piperazine
SMILESCC1(C)C(N2CCNCC2)CCN1C1CCCC1
InChIInChI=1S/C15H29N3/c1-15(2)14(17-11-8-16-9-12-17)7-10-18(15)13-5-3-4-6-13/h13-14,16H,3-12H2,1-2H3
InChIKeyODAKXKQMYOUABH-UHFFFAOYSA-N
XLogP1.69
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.42
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(1-cyclohexyl-5,5-dimethylpyrrolidin-3-yl)piperazine
CID 117018992
1-cyclopentylpiperazine;ethane
CID 143559542
1-(2,2-dimethyl-3-piperazin-1-ylpyrrolidin-1-yl)-2-methylpropan-1-one
CID 115268920
1-(1-tert-butyl-2,2-dimethylpiperidin-3-yl)piperazine
CID 117019904
1-cycloheptylpiperazine;methane
CID 143122535
1-cycloheptyl-2,2-dimethylpiperazine
CID 65460692
1-(1-cyclopropyl-4,4-dimethylpiperidin-3-yl)piperazine
CID 117025945
1-cycloheptyl-2,2-dimethylpyrrolidin-3-ol
CID 117016811
3-chloro-1-cyclohexyl-2,2-dimethylpyrrolidine
CID 131115710
1-cyclobutyl-2,2-dimethylpiperazine
CID 59454526
1-(2,2-dimethyl-3-piperazin-1-ylpyrrolidin-1-yl)pentan-1-one
CID 115268922
1,4-diazabicyclo[6.2.0]decane
CID 118210284

Frequently Asked Questions

What is the IUPAC name of 1-(1-cyclopentyl-2,2-dimethylpyrrolidin-3-yl)piperazine?
The IUPAC name of 1-(1-cyclopentyl-2,2-dimethylpyrrolidin-3-yl)piperazine (CID 117017868) is 1-(1-cyclopentyl-2,2-dimethylpyrrolidin-3-yl)piperazine.
What is the SMILES notation for 1-(1-cyclopentyl-2,2-dimethylpyrrolidin-3-yl)piperazine?
The canonical SMILES for 1-(1-cyclopentyl-2,2-dimethylpyrrolidin-3-yl)piperazine is CC1(C)C(N2CCNCC2)CCN1C1CCCC1.
What is the InChIKey of 1-(1-cyclopentyl-2,2-dimethylpyrrolidin-3-yl)piperazine?
The InChIKey is ODAKXKQMYOUABH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3/c1-15(2)14(17-11-8-16-9-12-17)7-10-18(15)13-5-3-4-6-13/h13-14,16H,3-12H2,1-2H3.
What are the key properties of 1-(1-cyclopentyl-2,2-dimethylpyrrolidin-3-yl)piperazine?
1-(1-cyclopentyl-2,2-dimethylpyrrolidin-3-yl)piperazine has a molecular weight of 251.42 g/mol, XLogP of 1.69, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-cyclopentyl-2,2-dimethylpyrrolidin-3-yl)piperazine is sourced from PubChem (CID 117017868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).