2-cyclopropyl-2,5-dimethyl-1-(1-oxaspiro[4.4]nonan-2-ylmethyl)piperazine

C18H32N2O — CID 102901615

IUPAC2-cyclopropyl-2,5-dimethyl-1-(1-oxaspiro[4.4]nonan-2-ylmethyl)piperazine
SMILESCC1CN(CC2CCC3(CCCC3)O2)C(C)(C2CC2)CN1
InChIInChI=1S/C18H32N2O/c1-14-11-20(17(2,13-19-14)15-5-6-15)12-16-7-10-18(21-16)8-3-4-9-18/h14-16,19H,3-13H2,1-2H3
InChIKeyMYUOGODFQMXMFF-UHFFFAOYSA-N
MW292.47 g/mol
LogP2.94
Rot. Bonds3

About 2-cyclopropyl-2,5-dimethyl-1-(1-oxaspiro[4.4]nonan-2-ylmethyl)piperazine

2-cyclopropyl-2,5-dimethyl-1-(1-oxaspiro[4.4]nonan-2-ylmethyl)piperazine (PubChem CID 102901615) has the molecular formula C18H32N2O and a molecular weight of 292.47 g/mol. Its IUPAC name is 2-cyclopropyl-2,5-dimethyl-1-(1-oxaspiro[4.4]nonan-2-ylmethyl)piperazine.

Molecular Properties

Compound Name2-cyclopropyl-2,5-dimethyl-1-(1-oxaspiro[4.4]nonan-2-ylmethyl)piperazine
PubChem CID102901615
Molecular FormulaC18H32N2O
Molecular Weight292.47 g/mol
Exact Mass292.25
IUPAC Name2-cyclopropyl-2,5-dimethyl-1-(1-oxaspiro[4.4]nonan-2-ylmethyl)piperazine
SMILESCC1CN(CC2CCC3(CCCC3)O2)C(C)(C2CC2)CN1
InChIInChI=1S/C18H32N2O/c1-14-11-20(17(2,13-19-14)15-5-6-15)12-16-7-10-18(21-16)8-3-4-9-18/h14-16,19H,3-13H2,1-2H3
InChIKeyMYUOGODFQMXMFF-UHFFFAOYSA-N
XLogP2.94
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.47
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-ethyl-2,2-dimethyl-1-(1-oxaspiro[4.4]nonan-2-ylmethyl)piperazine
CID 102901639
3,7-dimethyl-1-(1-oxaspiro[4.4]nonan-2-ylmethyl)-1,4-diazepane
CID 102901677
2-cyclopropyl-2,5-dimethyl-1-(oxan-4-ylmethyl)piperazine
CID 64844581
2,5-diethyl-2-methyl-1-(1-oxaspiro[4.4]nonan-2-ylmethyl)piperazine
CID 102901640
2-ethyl-5,5-dimethyl-1-(1-oxaspiro[4.4]nonan-2-ylmethyl)piperazine
CID 102901626
1-butyl-2-cyclopropyl-2,5-dimethylpiperazine
CID 64844568
2,2-diethyl-1-(1-oxaspiro[4.5]decan-2-ylmethyl)piperazine
CID 102901590
1-[(E)-but-2-enyl]-2-cyclopropyl-2,5-dimethylpiperazine
CID 107897896
5,5-diethyl-2-methyl-1-(1-oxaspiro[4.4]nonan-2-ylmethyl)piperazine
CID 102901650
2-cyclopropyl-2,5-dimethyl-1-(2-methylbutyl)piperazine
CID 64844970
2-cyclopropyl-2,5-dimethyl-1-(3,3,3-trifluoropropyl)piperazine
CID 64843995
5-(1-oxaspiro[4.5]decan-2-ylmethyl)-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole
CID 102848065

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-2,5-dimethyl-1-(1-oxaspiro[4.4]nonan-2-ylmethyl)piperazine?
The IUPAC name of 2-cyclopropyl-2,5-dimethyl-1-(1-oxaspiro[4.4]nonan-2-ylmethyl)piperazine (CID 102901615) is 2-cyclopropyl-2,5-dimethyl-1-(1-oxaspiro[4.4]nonan-2-ylmethyl)piperazine.
What is the SMILES notation for 2-cyclopropyl-2,5-dimethyl-1-(1-oxaspiro[4.4]nonan-2-ylmethyl)piperazine?
The canonical SMILES for 2-cyclopropyl-2,5-dimethyl-1-(1-oxaspiro[4.4]nonan-2-ylmethyl)piperazine is CC1CN(CC2CCC3(CCCC3)O2)C(C)(C2CC2)CN1.
What is the InChIKey of 2-cyclopropyl-2,5-dimethyl-1-(1-oxaspiro[4.4]nonan-2-ylmethyl)piperazine?
The InChIKey is MYUOGODFQMXMFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H32N2O/c1-14-11-20(17(2,13-19-14)15-5-6-15)12-16-7-10-18(21-16)8-3-4-9-18/h14-16,19H,3-13H2,1-2H3.
What are the key properties of 2-cyclopropyl-2,5-dimethyl-1-(1-oxaspiro[4.4]nonan-2-ylmethyl)piperazine?
2-cyclopropyl-2,5-dimethyl-1-(1-oxaspiro[4.4]nonan-2-ylmethyl)piperazine has a molecular weight of 292.47 g/mol, XLogP of 2.94, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2,5-dimethyl-1-(1-oxaspiro[4.4]nonan-2-ylmethyl)piperazine is sourced from PubChem (CID 102901615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).