2-cyclopropyl-5-ethyl-5-methyl-1-[(5-methyloxolan-2-yl)methyl]piperazine

C16H30N2O — CID 103141435

IUPAC2-cyclopropyl-5-ethyl-5-methyl-1-[(5-methyloxolan-2-yl)methyl]piperazine
SMILESCCC1(C)CN(CC2CCC(C)O2)C(C2CC2)CN1
InChIInChI=1S/C16H30N2O/c1-4-16(3)11-18(10-14-8-5-12(2)19-14)15(9-17-16)13-6-7-13/h12-15,17H,4-11H2,1-3H3
InChIKeyGSMDAZAENOQUHH-UHFFFAOYSA-N
MW266.43 g/mol
LogP2.41
Rot. Bonds4

About 2-cyclopropyl-5-ethyl-5-methyl-1-[(5-methyloxolan-2-yl)methyl]piperazine

2-cyclopropyl-5-ethyl-5-methyl-1-[(5-methyloxolan-2-yl)methyl]piperazine (PubChem CID 103141435) has the molecular formula C16H30N2O and a molecular weight of 266.43 g/mol. Its IUPAC name is 2-cyclopropyl-5-ethyl-5-methyl-1-[(5-methyloxolan-2-yl)methyl]piperazine.

Molecular Properties

Compound Name2-cyclopropyl-5-ethyl-5-methyl-1-[(5-methyloxolan-2-yl)methyl]piperazine
PubChem CID103141435
Molecular FormulaC16H30N2O
Molecular Weight266.43 g/mol
Exact Mass266.24
IUPAC Name2-cyclopropyl-5-ethyl-5-methyl-1-[(5-methyloxolan-2-yl)methyl]piperazine
SMILESCCC1(C)CN(CC2CCC(C)O2)C(C2CC2)CN1
InChIInChI=1S/C16H30N2O/c1-4-16(3)11-18(10-14-8-5-12(2)19-14)15(9-17-16)13-6-7-13/h12-15,17H,4-11H2,1-3H3
InChIKeyGSMDAZAENOQUHH-UHFFFAOYSA-N
XLogP2.41
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-cyclopropyl-5-ethyl-5-methyl-1-[(5-methyloxolan-2-yl)methyl]piperazine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-5-ethyl-5-methyl-1-[(5-methyloxolan-2-yl)methyl]piperazine?
The IUPAC name of 2-cyclopropyl-5-ethyl-5-methyl-1-[(5-methyloxolan-2-yl)methyl]piperazine (CID 103141435) is 2-cyclopropyl-5-ethyl-5-methyl-1-[(5-methyloxolan-2-yl)methyl]piperazine.
What is the SMILES notation for 2-cyclopropyl-5-ethyl-5-methyl-1-[(5-methyloxolan-2-yl)methyl]piperazine?
The canonical SMILES for 2-cyclopropyl-5-ethyl-5-methyl-1-[(5-methyloxolan-2-yl)methyl]piperazine is CCC1(C)CN(CC2CCC(C)O2)C(C2CC2)CN1.
What is the InChIKey of 2-cyclopropyl-5-ethyl-5-methyl-1-[(5-methyloxolan-2-yl)methyl]piperazine?
The InChIKey is GSMDAZAENOQUHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O/c1-4-16(3)11-18(10-14-8-5-12(2)19-14)15(9-17-16)13-6-7-13/h12-15,17H,4-11H2,1-3H3.
What are the key properties of 2-cyclopropyl-5-ethyl-5-methyl-1-[(5-methyloxolan-2-yl)methyl]piperazine?
2-cyclopropyl-5-ethyl-5-methyl-1-[(5-methyloxolan-2-yl)methyl]piperazine has a molecular weight of 266.43 g/mol, XLogP of 2.41, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-5-ethyl-5-methyl-1-[(5-methyloxolan-2-yl)methyl]piperazine is sourced from PubChem (CID 103141435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).