(2S)-2-methyl-1-[(2R)-2-phenylpropyl]piperazine

C14H22N2 — CID 96906178

IUPAC(2S)-2-methyl-1-[(2R)-2-phenylpropyl]piperazine
SMILESC[C@@H](CN1CCNC[C@@H]1C)c1ccccc1
InChIInChI=1S/C14H22N2/c1-12(14-6-4-3-5-7-14)11-16-9-8-15-10-13(16)2/h3-7,12-13,15H,8-11H2,1-2H3/t12-,13-/m0/s1
InChIKeyPFCGFSCWLYDURJ-STQMWFEESA-N
MW218.34 g/mol
LogP2.08
Rot. Bonds3

About (2S)-2-methyl-1-[(2R)-2-phenylpropyl]piperazine

(2S)-2-methyl-1-[(2R)-2-phenylpropyl]piperazine (PubChem CID 96906178) has the molecular formula C14H22N2 and a molecular weight of 218.34 g/mol. Its IUPAC name is (2S)-2-methyl-1-[(2R)-2-phenylpropyl]piperazine.

Molecular Properties

Compound Name(2S)-2-methyl-1-[(2R)-2-phenylpropyl]piperazine
PubChem CID96906178
Molecular FormulaC14H22N2
Molecular Weight218.34 g/mol
Exact Mass218.18
IUPAC Name(2S)-2-methyl-1-[(2R)-2-phenylpropyl]piperazine
SMILESC[C@@H](CN1CCNC[C@@H]1C)c1ccccc1
InChIInChI=1S/C14H22N2/c1-12(14-6-4-3-5-7-14)11-16-9-8-15-10-13(16)2/h3-7,12-13,15H,8-11H2,1-2H3/t12-,13-/m0/s1
InChIKeyPFCGFSCWLYDURJ-STQMWFEESA-N
XLogP2.08
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (2S)-2-methyl-1-[(2R)-2-phenylpropyl]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

(2S)-2-methyl-1-(2-phenylpropyl)piperazine;hydrochloride
CID 120839154
1-[2-(4-fluorophenyl)propyl]-2-methylpiperazine
CID 120837102
2-[(2S)-2-methylpiperazin-1-yl]-1-phenylethanol
CID 82755402
2-methyl-1-(2-methylpropyl)piperazine
CID 53405905
2-(1-methylimidazol-2-yl)-1-(2-phenylpropyl)piperazine;hydrochloride
CID 120911731
2-methyl-1-(3-phenylprop-2-enyl)piperazine
CID 75598897
2-methyl-1-(1-phenylethyl)-1,4-diazepane
CID 82242013
1-(3-methoxyphenyl)-2-[(2S)-2-methylpiperazin-1-yl]ethanol
CID 82755808
3-methyl-1-(2-phenylpropyl)piperazine
CID 65416584
2-methyl-1-(4-phenylbutan-2-yl)piperazine
CID 64932306
3-amino-1-(2-methylpiperazin-1-yl)-3-phenylpropan-1-one;dihydrochloride
CID 122151289
2-(2-methylpiperazin-1-yl)-1-(4-phenylperoxyphenyl)ethanone
CID 155756342

Frequently Asked Questions

What is the IUPAC name of (2S)-2-methyl-1-[(2R)-2-phenylpropyl]piperazine?
The IUPAC name of (2S)-2-methyl-1-[(2R)-2-phenylpropyl]piperazine (CID 96906178) is (2S)-2-methyl-1-[(2R)-2-phenylpropyl]piperazine.
What is the SMILES notation for (2S)-2-methyl-1-[(2R)-2-phenylpropyl]piperazine?
The canonical SMILES for (2S)-2-methyl-1-[(2R)-2-phenylpropyl]piperazine is C[C@@H](CN1CCNC[C@@H]1C)c1ccccc1.
What is the InChIKey of (2S)-2-methyl-1-[(2R)-2-phenylpropyl]piperazine?
The InChIKey is PFCGFSCWLYDURJ-STQMWFEESA-N. The full InChI is InChI=1S/C14H22N2/c1-12(14-6-4-3-5-7-14)11-16-9-8-15-10-13(16)2/h3-7,12-13,15H,8-11H2,1-2H3/t12-,13-/m0/s1.
What are the key properties of (2S)-2-methyl-1-[(2R)-2-phenylpropyl]piperazine?
(2S)-2-methyl-1-[(2R)-2-phenylpropyl]piperazine has a molecular weight of 218.34 g/mol, XLogP of 2.08, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-methyl-1-[(2R)-2-phenylpropyl]piperazine is sourced from PubChem (CID 96906178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).