1-(cyclobutylmethyl)-5-ethyl-5-methyl-2-(2-methylpropyl)piperazine

C16H32N2 — CID 65463085

IUPAC1-(cyclobutylmethyl)-5-ethyl-5-methyl-2-(2-methylpropyl)piperazine
SMILESCCC1(C)CN(CC2CCC2)C(CC(C)C)CN1
InChIInChI=1S/C16H32N2/c1-5-16(4)12-18(11-14-7-6-8-14)15(10-17-16)9-13(2)3/h13-15,17H,5-12H2,1-4H3
InChIKeyCQEDKBHOPZHFJL-UHFFFAOYSA-N
MW252.45 g/mol
LogP3.28
Rot. Bonds5

About 1-(cyclobutylmethyl)-5-ethyl-5-methyl-2-(2-methylpropyl)piperazine

1-(cyclobutylmethyl)-5-ethyl-5-methyl-2-(2-methylpropyl)piperazine (PubChem CID 65463085) has the molecular formula C16H32N2 and a molecular weight of 252.45 g/mol. Its IUPAC name is 1-(cyclobutylmethyl)-5-ethyl-5-methyl-2-(2-methylpropyl)piperazine.

Molecular Properties

Compound Name1-(cyclobutylmethyl)-5-ethyl-5-methyl-2-(2-methylpropyl)piperazine
PubChem CID65463085
Molecular FormulaC16H32N2
Molecular Weight252.45 g/mol
Exact Mass252.26
IUPAC Name1-(cyclobutylmethyl)-5-ethyl-5-methyl-2-(2-methylpropyl)piperazine
SMILESCCC1(C)CN(CC2CCC2)C(CC(C)C)CN1
InChIInChI=1S/C16H32N2/c1-5-16(4)12-18(11-14-7-6-8-14)15(10-17-16)9-13(2)3/h13-15,17H,5-12H2,1-4H3
InChIKeyCQEDKBHOPZHFJL-UHFFFAOYSA-N
XLogP3.28
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.45
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(cyclobutylmethyl)-5-ethyl-5-methyl-2-(2-methylpropyl)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 1-(cyclobutylmethyl)-5-ethyl-5-methyl-2-(2-methylpropyl)piperazine?
The IUPAC name of 1-(cyclobutylmethyl)-5-ethyl-5-methyl-2-(2-methylpropyl)piperazine (CID 65463085) is 1-(cyclobutylmethyl)-5-ethyl-5-methyl-2-(2-methylpropyl)piperazine.
What is the SMILES notation for 1-(cyclobutylmethyl)-5-ethyl-5-methyl-2-(2-methylpropyl)piperazine?
The canonical SMILES for 1-(cyclobutylmethyl)-5-ethyl-5-methyl-2-(2-methylpropyl)piperazine is CCC1(C)CN(CC2CCC2)C(CC(C)C)CN1.
What is the InChIKey of 1-(cyclobutylmethyl)-5-ethyl-5-methyl-2-(2-methylpropyl)piperazine?
The InChIKey is CQEDKBHOPZHFJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2/c1-5-16(4)12-18(11-14-7-6-8-14)15(10-17-16)9-13(2)3/h13-15,17H,5-12H2,1-4H3.
What are the key properties of 1-(cyclobutylmethyl)-5-ethyl-5-methyl-2-(2-methylpropyl)piperazine?
1-(cyclobutylmethyl)-5-ethyl-5-methyl-2-(2-methylpropyl)piperazine has a molecular weight of 252.45 g/mol, XLogP of 3.28, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclobutylmethyl)-5-ethyl-5-methyl-2-(2-methylpropyl)piperazine is sourced from PubChem (CID 65463085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).