1-[2-(2-methylbutan-2-yl)phenyl]piperazine

C15H24N2 — CID 155119866

IUPAC1-[2-(2-methylbutan-2-yl)phenyl]piperazine
SMILESCCC(C)(C)c1ccccc1N1CCNCC1
InChIInChI=1S/C15H24N2/c1-4-15(2,3)13-7-5-6-8-14(13)17-11-9-16-10-12-17/h5-8,16H,4,9-12H2,1-3H3
InChIKeyFXVCPBRAOXMMLH-UHFFFAOYSA-N
MW232.37 g/mol
LogP2.78
Rot. Bonds3

About 1-[2-(2-methylbutan-2-yl)phenyl]piperazine

1-[2-(2-methylbutan-2-yl)phenyl]piperazine (PubChem CID 155119866) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is 1-[2-(2-methylbutan-2-yl)phenyl]piperazine.

Molecular Properties

Compound Name1-[2-(2-methylbutan-2-yl)phenyl]piperazine
PubChem CID155119866
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC Name1-[2-(2-methylbutan-2-yl)phenyl]piperazine
SMILESCCC(C)(C)c1ccccc1N1CCNCC1
InChIInChI=1S/C15H24N2/c1-4-15(2,3)13-7-5-6-8-14(13)17-11-9-16-10-12-17/h5-8,16H,4,9-12H2,1-3H3
InChIKeyFXVCPBRAOXMMLH-UHFFFAOYSA-N
XLogP2.78
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-[2-(2-methylbutan-2-yl)phenyl]piperazine with MolForge

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

Launch Full Analysis

Related Compounds

1-(2-piperazin-1-ylphenyl)piperazine;hydrobromide
CID 118703673
1-(2-chlorophenyl)piperazine;dihydrochloride
CID 3018683
1-(2-methylsulfanylphenyl)piperazine;hydrochloride
CID 76852196
(2-piperazin-1-ylphenyl)methanamine;hydrochloride
CID 174363608
ethane;1-(2-ethoxyphenyl)piperazine
CID 142040905
1-(2-butylphenyl)piperazine
CID 14479835
1-(2-chlorophenyl)piperazine
CID 162116490
1-[2-(4-tert-butylphenyl)sulfanylphenyl]piperazine;hydrochloride
CID 53237663
1-(2-piperazin-1-ylphenyl)propan-1-one
CID 139690573
1-(2-propan-2-ylphenyl)piperazine
CID 3608822
1-(2-chlorophenyl)piperazine;1-(2-chlorophenyl)piperidine;hydrochloride
CID 157420030
1,3-bis(2-tert-butylphenyl)imidazolidine;hydrochloride
CID 173045672

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-methylbutan-2-yl)phenyl]piperazine?
The IUPAC name of 1-[2-(2-methylbutan-2-yl)phenyl]piperazine (CID 155119866) is 1-[2-(2-methylbutan-2-yl)phenyl]piperazine.
What is the SMILES notation for 1-[2-(2-methylbutan-2-yl)phenyl]piperazine?
The canonical SMILES for 1-[2-(2-methylbutan-2-yl)phenyl]piperazine is CCC(C)(C)c1ccccc1N1CCNCC1.
What is the InChIKey of 1-[2-(2-methylbutan-2-yl)phenyl]piperazine?
The InChIKey is FXVCPBRAOXMMLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-4-15(2,3)13-7-5-6-8-14(13)17-11-9-16-10-12-17/h5-8,16H,4,9-12H2,1-3H3.
What are the key properties of 1-[2-(2-methylbutan-2-yl)phenyl]piperazine?
1-[2-(2-methylbutan-2-yl)phenyl]piperazine has a molecular weight of 232.37 g/mol, XLogP of 2.78, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-methylbutan-2-yl)phenyl]piperazine is sourced from PubChem (CID 155119866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).