2-methyl-1-(2-methyloxan-4-yl)-5-(2-methylpropyl)piperazine

C15H30N2O — CID 114109435

IUPAC2-methyl-1-(2-methyloxan-4-yl)-5-(2-methylpropyl)piperazine
SMILESCC(C)CC1CN(C2CCOC(C)C2)C(C)CN1
InChIInChI=1S/C15H30N2O/c1-11(2)7-14-10-17(12(3)9-16-14)15-5-6-18-13(4)8-15/h11-16H,5-10H2,1-4H3
InChIKeyHVHKSTIJYVMDSR-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.26
Rot. Bonds3

About 2-methyl-1-(2-methyloxan-4-yl)-5-(2-methylpropyl)piperazine

2-methyl-1-(2-methyloxan-4-yl)-5-(2-methylpropyl)piperazine (PubChem CID 114109435) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is 2-methyl-1-(2-methyloxan-4-yl)-5-(2-methylpropyl)piperazine.

Molecular Properties

Compound Name2-methyl-1-(2-methyloxan-4-yl)-5-(2-methylpropyl)piperazine
PubChem CID114109435
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC Name2-methyl-1-(2-methyloxan-4-yl)-5-(2-methylpropyl)piperazine
SMILESCC(C)CC1CN(C2CCOC(C)C2)C(C)CN1
InChIInChI=1S/C15H30N2O/c1-11(2)7-14-10-17(12(3)9-16-14)15-5-6-18-13(4)8-15/h11-16H,5-10H2,1-4H3
InChIKeyHVHKSTIJYVMDSR-UHFFFAOYSA-N
XLogP2.26
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-cyclohexyl-1-cyclopentyl-5-(2-methylpropyl)piperazine
CID 82925572
1-cyclooctyl-2-ethyl-5-(2-methylpropyl)piperazine
CID 64931371
1-(2-methylcyclopentyl)-5-(2-methylpropyl)-2-propan-2-ylpiperazine
CID 64941388
4-methyl-5-(2-methyloxan-4-yl)-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole
CID 66213020
2-methyl-1-(4-methylpentyl)-5-(2-methylpropyl)piperazine
CID 64939631
1-but-3-yn-2-yl-2-methyl-5-(2-methylpropyl)piperazine
CID 114420418
3-butan-2-yl-1-(2-methyloxan-4-yl)piperazine
CID 114109431
2-methyl-1-(2-methyloxolan-3-yl)-5-propan-2-ylpiperazine
CID 82736442
2-ethyl-5-(2-methylpropyl)-1-(2,2,3,3-tetramethylcyclopropyl)piperazine
CID 79351246
(3R)-3-methyl-1-[(2S)-2-methyloxan-4-yl]piperazine
CID 156515970
2-cyclopropyl-1-[(5-methyloxolan-2-yl)methyl]-5-(2-methylpropyl)piperazine
CID 103141376
1-(4-methoxybutan-2-yl)-2-methyl-5-(2-methylpropyl)piperazine
CID 64939365

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(2-methyloxan-4-yl)-5-(2-methylpropyl)piperazine?
The IUPAC name of 2-methyl-1-(2-methyloxan-4-yl)-5-(2-methylpropyl)piperazine (CID 114109435) is 2-methyl-1-(2-methyloxan-4-yl)-5-(2-methylpropyl)piperazine.
What is the SMILES notation for 2-methyl-1-(2-methyloxan-4-yl)-5-(2-methylpropyl)piperazine?
The canonical SMILES for 2-methyl-1-(2-methyloxan-4-yl)-5-(2-methylpropyl)piperazine is CC(C)CC1CN(C2CCOC(C)C2)C(C)CN1.
What is the InChIKey of 2-methyl-1-(2-methyloxan-4-yl)-5-(2-methylpropyl)piperazine?
The InChIKey is HVHKSTIJYVMDSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-11(2)7-14-10-17(12(3)9-16-14)15-5-6-18-13(4)8-15/h11-16H,5-10H2,1-4H3.
What are the key properties of 2-methyl-1-(2-methyloxan-4-yl)-5-(2-methylpropyl)piperazine?
2-methyl-1-(2-methyloxan-4-yl)-5-(2-methylpropyl)piperazine has a molecular weight of 254.42 g/mol, XLogP of 2.26, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(2-methyloxan-4-yl)-5-(2-methylpropyl)piperazine is sourced from PubChem (CID 114109435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).