1-[(5,5-dimethyloxolan-2-yl)methyl]-2,5-diethyl-5-methylpiperazine

C16H32N2O — CID 116524523

IUPAC1-[(5,5-dimethyloxolan-2-yl)methyl]-2,5-diethyl-5-methylpiperazine
SMILESCCC1CNC(C)(CC)CN1CC1CCC(C)(C)O1
InChIInChI=1S/C16H32N2O/c1-6-13-10-17-16(5,7-2)12-18(13)11-14-8-9-15(3,4)19-14/h13-14,17H,6-12H2,1-5H3
InChIKeyDTTYZOKRNNLPHN-UHFFFAOYSA-N
MW268.44 g/mol
LogP2.80
Rot. Bonds4

About 1-[(5,5-dimethyloxolan-2-yl)methyl]-2,5-diethyl-5-methylpiperazine

1-[(5,5-dimethyloxolan-2-yl)methyl]-2,5-diethyl-5-methylpiperazine (PubChem CID 116524523) has the molecular formula C16H32N2O and a molecular weight of 268.44 g/mol. Its IUPAC name is 1-[(5,5-dimethyloxolan-2-yl)methyl]-2,5-diethyl-5-methylpiperazine.

Molecular Properties

Compound Name1-[(5,5-dimethyloxolan-2-yl)methyl]-2,5-diethyl-5-methylpiperazine
PubChem CID116524523
Molecular FormulaC16H32N2O
Molecular Weight268.44 g/mol
Exact Mass268.25
IUPAC Name1-[(5,5-dimethyloxolan-2-yl)methyl]-2,5-diethyl-5-methylpiperazine
SMILESCCC1CNC(C)(CC)CN1CC1CCC(C)(C)O1
InChIInChI=1S/C16H32N2O/c1-6-13-10-17-16(5,7-2)12-18(13)11-14-8-9-15(3,4)19-14/h13-14,17H,6-12H2,1-5H3
InChIKeyDTTYZOKRNNLPHN-UHFFFAOYSA-N
XLogP2.80
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.44
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,5-diethyl-1-[(4-ethylcyclohexyl)methyl]-5-methylpiperazine
CID 64946947
2-ethyl-5,5-dimethyl-1-(1-oxaspiro[4.4]nonan-2-ylmethyl)piperazine
CID 102901626
1-[(5,5-dimethyloxolan-2-yl)methyl]-2-ethyl-5-propylpiperazine
CID 116524455
2,5-diethyl-1-[(1-ethylcyclopropyl)methyl]-5-methylpiperazine
CID 114102157
1-butyl-2,5-diethyl-5-methylpiperazine
CID 64847702
1-[(5,5-dimethyloxolan-2-yl)methyl]-3,3-diethyl-7-methyl-1,4-diazepane
CID 116524616
2,5-diethyl-5-methyl-1-prop-2-ynylpiperazine
CID 64933219
1-cyclopentyl-2,5-diethyl-5-methylpiperazine
CID 64931233
2,5-diethyl-5-methyl-1-[(2-methylthiolan-2-yl)methyl]piperazine
CID 80730833
1-cyclooctyl-2,5-diethyl-5-methylpiperazine
CID 64930575
3-(2,5-diethyl-5-methylpiperazin-1-yl)-N,N-dimethylpropan-1-amine
CID 64935969
2-cyclopropyl-5-ethyl-5-methyl-1-[(5-methyloxolan-2-yl)methyl]piperazine
CID 103141435

Frequently Asked Questions

What is the IUPAC name of 1-[(5,5-dimethyloxolan-2-yl)methyl]-2,5-diethyl-5-methylpiperazine?
The IUPAC name of 1-[(5,5-dimethyloxolan-2-yl)methyl]-2,5-diethyl-5-methylpiperazine (CID 116524523) is 1-[(5,5-dimethyloxolan-2-yl)methyl]-2,5-diethyl-5-methylpiperazine.
What is the SMILES notation for 1-[(5,5-dimethyloxolan-2-yl)methyl]-2,5-diethyl-5-methylpiperazine?
The canonical SMILES for 1-[(5,5-dimethyloxolan-2-yl)methyl]-2,5-diethyl-5-methylpiperazine is CCC1CNC(C)(CC)CN1CC1CCC(C)(C)O1.
What is the InChIKey of 1-[(5,5-dimethyloxolan-2-yl)methyl]-2,5-diethyl-5-methylpiperazine?
The InChIKey is DTTYZOKRNNLPHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O/c1-6-13-10-17-16(5,7-2)12-18(13)11-14-8-9-15(3,4)19-14/h13-14,17H,6-12H2,1-5H3.
What are the key properties of 1-[(5,5-dimethyloxolan-2-yl)methyl]-2,5-diethyl-5-methylpiperazine?
1-[(5,5-dimethyloxolan-2-yl)methyl]-2,5-diethyl-5-methylpiperazine has a molecular weight of 268.44 g/mol, XLogP of 2.80, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(5,5-dimethyloxolan-2-yl)methyl]-2,5-diethyl-5-methylpiperazine is sourced from PubChem (CID 116524523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).