2-methyl-1-(oxan-3-yl)piperazine

C10H20N2O — CID 64931525

IUPAC2-methyl-1-(oxan-3-yl)piperazine
SMILESCC1CNCCN1C1CCCOC1
InChIInChI=1S/C10H20N2O/c1-9-7-11-4-5-12(9)10-3-2-6-13-8-10/h9-11H,2-8H2,1H3
InChIKeyCKAMJALJVVDVLX-UHFFFAOYSA-N
MW184.28 g/mol
LogP0.46
Rot. Bonds1

About 2-methyl-1-(oxan-3-yl)piperazine

2-methyl-1-(oxan-3-yl)piperazine (PubChem CID 64931525) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is 2-methyl-1-(oxan-3-yl)piperazine.

Molecular Properties

Compound Name2-methyl-1-(oxan-3-yl)piperazine
PubChem CID64931525
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name2-methyl-1-(oxan-3-yl)piperazine
SMILESCC1CNCCN1C1CCCOC1
InChIInChI=1S/C10H20N2O/c1-9-7-11-4-5-12(9)10-3-2-6-13-8-10/h9-11H,2-8H2,1H3
InChIKeyCKAMJALJVVDVLX-UHFFFAOYSA-N
XLogP0.46
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 50.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(oxan-3-yl)piperazine?
The IUPAC name of 2-methyl-1-(oxan-3-yl)piperazine (CID 64931525) is 2-methyl-1-(oxan-3-yl)piperazine.
What is the SMILES notation for 2-methyl-1-(oxan-3-yl)piperazine?
The canonical SMILES for 2-methyl-1-(oxan-3-yl)piperazine is CC1CNCCN1C1CCCOC1.
What is the InChIKey of 2-methyl-1-(oxan-3-yl)piperazine?
The InChIKey is CKAMJALJVVDVLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-9-7-11-4-5-12(9)10-3-2-6-13-8-10/h9-11H,2-8H2,1H3.
What are the key properties of 2-methyl-1-(oxan-3-yl)piperazine?
2-methyl-1-(oxan-3-yl)piperazine has a molecular weight of 184.28 g/mol, XLogP of 0.46, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(oxan-3-yl)piperazine is sourced from PubChem (CID 64931525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).