1-(oxolan-2-ylmethyl)-2,5-di(propan-2-yl)piperazine

C15H30N2O — CID 64839224

IUPAC1-(oxolan-2-ylmethyl)-2,5-di(propan-2-yl)piperazine
SMILESCC(C)C1CN(CC2CCCO2)C(C(C)C)CN1
InChIInChI=1S/C15H30N2O/c1-11(2)14-10-17(9-13-6-5-7-18-13)15(8-16-14)12(3)4/h11-16H,5-10H2,1-4H3
InChIKeyXEWDXRVZFGXOCG-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.12
Rot. Bonds4

About 1-(oxolan-2-ylmethyl)-2,5-di(propan-2-yl)piperazine

1-(oxolan-2-ylmethyl)-2,5-di(propan-2-yl)piperazine (PubChem CID 64839224) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is 1-(oxolan-2-ylmethyl)-2,5-di(propan-2-yl)piperazine.

Molecular Properties

Compound Name1-(oxolan-2-ylmethyl)-2,5-di(propan-2-yl)piperazine
PubChem CID64839224
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC Name1-(oxolan-2-ylmethyl)-2,5-di(propan-2-yl)piperazine
SMILESCC(C)C1CN(CC2CCCO2)C(C(C)C)CN1
InChIInChI=1S/C15H30N2O/c1-11(2)14-10-17(9-13-6-5-7-18-13)15(8-16-14)12(3)4/h11-16H,5-10H2,1-4H3
InChIKeyXEWDXRVZFGXOCG-UHFFFAOYSA-N
XLogP2.12
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-tert-butyl-1-[2-(oxolan-2-yl)ethyl]-2-propan-2-ylpiperazine
CID 64947681
5-butan-2-yl-2-tert-butyl-1-(oxan-2-ylmethyl)piperazine
CID 64847284
2-cyclopropyl-2-methyl-1-(oxan-2-ylmethyl)-5-propan-2-ylpiperazine
CID 64838500
4-(oxan-2-ylmethyl)-3-propan-2-yl-1,4-diazaspiro[5.5]undecane
CID 64875697
2,2-dimethyl-1-(oxan-2-ylmethyl)-5-propan-2-ylpiperazine
CID 64839838
2,5-di(propan-2-yl)-1-prop-2-ynylpiperazine
CID 64937920
1-(2-piperidin-1-ylethyl)-2,5-di(propan-2-yl)piperazine
CID 82249272
1-(2-cyclopentyloxyethyl)-2,5-di(propan-2-yl)piperazine
CID 64938773
2-[(5-ethyl-2-propan-2-ylpiperazin-1-yl)methyl]-4-methylmorpholine
CID 79077325
(1R,4S)-2-[[(2S)-oxolan-2-yl]methyl]-2,5-diazabicyclo[2.2.1]heptane
CID 99987690
2-(2-methylpropyl)-1-(oxolan-2-ylmethyl)-5-propylpiperazine
CID 64838798
5-[[2,5-di(propan-2-yl)piperazin-1-yl]methyl]-1,2-oxazole
CID 114186794

Frequently Asked Questions

What is the IUPAC name of 1-(oxolan-2-ylmethyl)-2,5-di(propan-2-yl)piperazine?
The IUPAC name of 1-(oxolan-2-ylmethyl)-2,5-di(propan-2-yl)piperazine (CID 64839224) is 1-(oxolan-2-ylmethyl)-2,5-di(propan-2-yl)piperazine.
What is the SMILES notation for 1-(oxolan-2-ylmethyl)-2,5-di(propan-2-yl)piperazine?
The canonical SMILES for 1-(oxolan-2-ylmethyl)-2,5-di(propan-2-yl)piperazine is CC(C)C1CN(CC2CCCO2)C(C(C)C)CN1.
What is the InChIKey of 1-(oxolan-2-ylmethyl)-2,5-di(propan-2-yl)piperazine?
The InChIKey is XEWDXRVZFGXOCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-11(2)14-10-17(9-13-6-5-7-18-13)15(8-16-14)12(3)4/h11-16H,5-10H2,1-4H3.
What are the key properties of 1-(oxolan-2-ylmethyl)-2,5-di(propan-2-yl)piperazine?
1-(oxolan-2-ylmethyl)-2,5-di(propan-2-yl)piperazine has a molecular weight of 254.42 g/mol, XLogP of 2.12, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(oxolan-2-ylmethyl)-2,5-di(propan-2-yl)piperazine is sourced from PubChem (CID 64839224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).