2-(2-methylpropyl)-1-(oxolan-2-ylmethyl)-5-propylpiperazine

C16H32N2O — CID 64838798

IUPAC2-(2-methylpropyl)-1-(oxolan-2-ylmethyl)-5-propylpiperazine
SMILESCCCC1CN(CC2CCCO2)C(CC(C)C)CN1
InChIInChI=1S/C16H32N2O/c1-4-6-14-11-18(12-16-7-5-8-19-16)15(10-17-14)9-13(2)3/h13-17H,4-12H2,1-3H3
InChIKeyIYELEVGNVFNEIP-UHFFFAOYSA-N
MW268.44 g/mol
LogP2.65
Rot. Bonds6

About 2-(2-methylpropyl)-1-(oxolan-2-ylmethyl)-5-propylpiperazine

2-(2-methylpropyl)-1-(oxolan-2-ylmethyl)-5-propylpiperazine (PubChem CID 64838798) has the molecular formula C16H32N2O and a molecular weight of 268.44 g/mol. Its IUPAC name is 2-(2-methylpropyl)-1-(oxolan-2-ylmethyl)-5-propylpiperazine.

Molecular Properties

Compound Name2-(2-methylpropyl)-1-(oxolan-2-ylmethyl)-5-propylpiperazine
PubChem CID64838798
Molecular FormulaC16H32N2O
Molecular Weight268.44 g/mol
Exact Mass268.25
IUPAC Name2-(2-methylpropyl)-1-(oxolan-2-ylmethyl)-5-propylpiperazine
SMILESCCCC1CN(CC2CCCO2)C(CC(C)C)CN1
InChIInChI=1S/C16H32N2O/c1-4-6-14-11-18(12-16-7-5-8-19-16)15(10-17-14)9-13(2)3/h13-17H,4-12H2,1-3H3
InChIKeyIYELEVGNVFNEIP-UHFFFAOYSA-N
XLogP2.65
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.44
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(2-methylpropyl)-1-(oxolan-2-ylmethyl)-5-propylpiperazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(cyclopentylmethyl)-2-(2-methylpropyl)-5-propylpiperazine
CID 64840737
2-butan-2-yl-1-[2-(oxolan-2-yl)ethyl]-5-propylpiperazine
CID 65170424
2-(2-methylpropyl)-1-pentyl-5-propylpiperazine
CID 64839965
2,5-bis(2-methylpropyl)-1-(oxan-4-ylmethyl)piperazine
CID 64848743
1-[2-(3-methylbutoxy)ethyl]-2-(2-methylpropyl)-5-propylpiperazine
CID 64839963
2-(2-methylpropyl)-1-(2-propan-2-ylsulfonylethyl)-5-propylpiperazine
CID 106732868
1-(cyclopentylmethyl)-2-ethyl-5-propylpiperazine
CID 64845195
1-(cyclobutylmethyl)-2-ethyl-5-propylpiperazine
CID 64936155
5-[[2-(2-methylpropyl)-5-propylpiperazin-1-yl]methyl]-1,3-thiazole
CID 112644847
2-ethyl-5-(2-methylpropyl)-1-(oxan-3-ylmethyl)piperazine
CID 64947706
1-[(5,5-dimethyloxolan-2-yl)methyl]-2-ethyl-5-propylpiperazine
CID 116524455
5,5-dimethyl-2-(2-methylpropyl)-1-[2-(oxolan-2-yl)ethyl]piperazine
CID 65170378

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylpropyl)-1-(oxolan-2-ylmethyl)-5-propylpiperazine?
The IUPAC name of 2-(2-methylpropyl)-1-(oxolan-2-ylmethyl)-5-propylpiperazine (CID 64838798) is 2-(2-methylpropyl)-1-(oxolan-2-ylmethyl)-5-propylpiperazine.
What is the SMILES notation for 2-(2-methylpropyl)-1-(oxolan-2-ylmethyl)-5-propylpiperazine?
The canonical SMILES for 2-(2-methylpropyl)-1-(oxolan-2-ylmethyl)-5-propylpiperazine is CCCC1CN(CC2CCCO2)C(CC(C)C)CN1.
What is the InChIKey of 2-(2-methylpropyl)-1-(oxolan-2-ylmethyl)-5-propylpiperazine?
The InChIKey is IYELEVGNVFNEIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O/c1-4-6-14-11-18(12-16-7-5-8-19-16)15(10-17-14)9-13(2)3/h13-17H,4-12H2,1-3H3.
What are the key properties of 2-(2-methylpropyl)-1-(oxolan-2-ylmethyl)-5-propylpiperazine?
2-(2-methylpropyl)-1-(oxolan-2-ylmethyl)-5-propylpiperazine has a molecular weight of 268.44 g/mol, XLogP of 2.65, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylpropyl)-1-(oxolan-2-ylmethyl)-5-propylpiperazine is sourced from PubChem (CID 64838798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).