2-cyclopropyl-2,5-dimethyl-1-(oxan-4-ylmethyl)piperazine

C15H28N2O — CID 64844581

IUPAC2-cyclopropyl-2,5-dimethyl-1-(oxan-4-ylmethyl)piperazine
SMILESCC1CN(CC2CCOCC2)C(C)(C2CC2)CN1
InChIInChI=1S/C15H28N2O/c1-12-9-17(10-13-5-7-18-8-6-13)15(2,11-16-12)14-3-4-14/h12-14,16H,3-11H2,1-2H3
InChIKeyBYQRZOSAOMSCGB-UHFFFAOYSA-N
MW252.40 g/mol
LogP1.88
Rot. Bonds3

About 2-cyclopropyl-2,5-dimethyl-1-(oxan-4-ylmethyl)piperazine

2-cyclopropyl-2,5-dimethyl-1-(oxan-4-ylmethyl)piperazine (PubChem CID 64844581) has the molecular formula C15H28N2O and a molecular weight of 252.40 g/mol. Its IUPAC name is 2-cyclopropyl-2,5-dimethyl-1-(oxan-4-ylmethyl)piperazine.

Molecular Properties

Compound Name2-cyclopropyl-2,5-dimethyl-1-(oxan-4-ylmethyl)piperazine
PubChem CID64844581
Molecular FormulaC15H28N2O
Molecular Weight252.40 g/mol
Exact Mass252.22
IUPAC Name2-cyclopropyl-2,5-dimethyl-1-(oxan-4-ylmethyl)piperazine
SMILESCC1CN(CC2CCOCC2)C(C)(C2CC2)CN1
InChIInChI=1S/C15H28N2O/c1-12-9-17(10-13-5-7-18-8-6-13)15(2,11-16-12)14-3-4-14/h12-14,16H,3-11H2,1-2H3
InChIKeyBYQRZOSAOMSCGB-UHFFFAOYSA-N
XLogP1.88
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.40
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-tert-butyl-2-cyclopropyl-2-methyl-1-(oxan-4-ylmethyl)piperazine
CID 64842062
2,2-diethyl-5-methyl-1-(oxan-4-ylmethyl)piperazine
CID 64846119
5-tert-butyl-2-cyclopropyl-2-methyl-1-(oxolan-3-ylmethyl)piperazine
CID 64842063
2-cyclopropyl-2,5-dimethyl-1-(1-oxaspiro[4.4]nonan-2-ylmethyl)piperazine
CID 102901615
1-butyl-2-cyclopropyl-2,5-dimethylpiperazine
CID 64844568
1-[(E)-but-2-enyl]-2-cyclopropyl-2,5-dimethylpiperazine
CID 107897896
2-cyclopropyl-2,5-dimethyl-1-(2-methylbutyl)piperazine
CID 64844970
2-cyclopropyl-2,5-dimethyl-1-(3,3,3-trifluoropropyl)piperazine
CID 64843995
2-cyclopropyl-1,2,5-trimethylpiperazine
CID 64845552
2-cyclopropyl-2,5-dimethyl-1-(2-propoxyethyl)piperazine
CID 106458523
5-benzyl-2-cyclopropyl-1-(cyclopropylmethyl)-2-methylpiperazine
CID 64848984
5-cyclopropyl-2,2-diethyl-5-methyl-1-(oxan-4-ylmethyl)piperazine
CID 64860212

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-2,5-dimethyl-1-(oxan-4-ylmethyl)piperazine?
The IUPAC name of 2-cyclopropyl-2,5-dimethyl-1-(oxan-4-ylmethyl)piperazine (CID 64844581) is 2-cyclopropyl-2,5-dimethyl-1-(oxan-4-ylmethyl)piperazine.
What is the SMILES notation for 2-cyclopropyl-2,5-dimethyl-1-(oxan-4-ylmethyl)piperazine?
The canonical SMILES for 2-cyclopropyl-2,5-dimethyl-1-(oxan-4-ylmethyl)piperazine is CC1CN(CC2CCOCC2)C(C)(C2CC2)CN1.
What is the InChIKey of 2-cyclopropyl-2,5-dimethyl-1-(oxan-4-ylmethyl)piperazine?
The InChIKey is BYQRZOSAOMSCGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O/c1-12-9-17(10-13-5-7-18-8-6-13)15(2,11-16-12)14-3-4-14/h12-14,16H,3-11H2,1-2H3.
What are the key properties of 2-cyclopropyl-2,5-dimethyl-1-(oxan-4-ylmethyl)piperazine?
2-cyclopropyl-2,5-dimethyl-1-(oxan-4-ylmethyl)piperazine has a molecular weight of 252.40 g/mol, XLogP of 1.88, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2,5-dimethyl-1-(oxan-4-ylmethyl)piperazine is sourced from PubChem (CID 64844581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).