1-cyclopentyl-4-(3,3-diethoxypropyl)piperazine

C16H32N2O2 — CID 63629128

IUPAC1-cyclopentyl-4-(3,3-diethoxypropyl)piperazine
SMILESCCOC(CCN1CCN(C2CCCC2)CC1)OCC
InChIInChI=1S/C16H32N2O2/c1-3-19-16(20-4-2)9-10-17-11-13-18(14-12-17)15-7-5-6-8-15/h15-16H,3-14H2,1-2H3
InChIKeyLAOLDCNCKNRMBM-UHFFFAOYSA-N
MW284.44 g/mol
LogP2.34
Rot. Bonds8

About 1-cyclopentyl-4-(3,3-diethoxypropyl)piperazine

1-cyclopentyl-4-(3,3-diethoxypropyl)piperazine (PubChem CID 63629128) has the molecular formula C16H32N2O2 and a molecular weight of 284.44 g/mol. Its IUPAC name is 1-cyclopentyl-4-(3,3-diethoxypropyl)piperazine.

Molecular Properties

Compound Name1-cyclopentyl-4-(3,3-diethoxypropyl)piperazine
PubChem CID63629128
Molecular FormulaC16H32N2O2
Molecular Weight284.44 g/mol
Exact Mass284.25
IUPAC Name1-cyclopentyl-4-(3,3-diethoxypropyl)piperazine
SMILESCCOC(CCN1CCN(C2CCCC2)CC1)OCC
InChIInChI=1S/C16H32N2O2/c1-3-19-16(20-4-2)9-10-17-11-13-18(14-12-17)15-7-5-6-8-15/h15-16H,3-14H2,1-2H3
InChIKeyLAOLDCNCKNRMBM-UHFFFAOYSA-N
XLogP2.34
TPSA24.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.44
LogP ≤ 52.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

2-(3,3-diethoxypropyl)-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine
CID 79934926
2-(3,3-diethoxypropyl)-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine
CID 79943736
1-cyclopropyl-4-(2,2-diethoxyethyl)piperazine
CID 63619023
1-(3,3-diethoxypropyl)piperidin-3-ol
CID 63629790
1-(4-cyclopentylpiperazin-1-yl)-4,4-dimethylpentan-3-amine
CID 55098190
1-cyclopropyl-4-(2-propan-2-yloxyethyl)piperazine
CID 166028340
1-amino-4-(4-cyclopentylpiperazin-1-yl)butan-2-ol
CID 64821605
1-(3,3-diethoxypropyl)pyrrolidine-3,4-diol
CID 106670331
3-(3,3-diethoxypropyl)-8-oxa-3-azabicyclo[3.2.1]octane
CID 66391359
6-(4-cyclopentylpiperazin-1-yl)-N-methylhexan-3-amine
CID 106799730
1-(2-chloroethyl)-4-cyclopentylpiperazine
CID 4741622
1-cyclohexyl-4-ethylpiperazine;hydrochloride
CID 44598236

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-4-(3,3-diethoxypropyl)piperazine?
The IUPAC name of 1-cyclopentyl-4-(3,3-diethoxypropyl)piperazine (CID 63629128) is 1-cyclopentyl-4-(3,3-diethoxypropyl)piperazine.
What is the SMILES notation for 1-cyclopentyl-4-(3,3-diethoxypropyl)piperazine?
The canonical SMILES for 1-cyclopentyl-4-(3,3-diethoxypropyl)piperazine is CCOC(CCN1CCN(C2CCCC2)CC1)OCC.
What is the InChIKey of 1-cyclopentyl-4-(3,3-diethoxypropyl)piperazine?
The InChIKey is LAOLDCNCKNRMBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O2/c1-3-19-16(20-4-2)9-10-17-11-13-18(14-12-17)15-7-5-6-8-15/h15-16H,3-14H2,1-2H3.
What are the key properties of 1-cyclopentyl-4-(3,3-diethoxypropyl)piperazine?
1-cyclopentyl-4-(3,3-diethoxypropyl)piperazine has a molecular weight of 284.44 g/mol, XLogP of 2.34, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-4-(3,3-diethoxypropyl)piperazine is sourced from PubChem (CID 63629128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).