2-methyl-1-(4-phenylbutan-2-yl)piperazine

C15H24N2 — CID 64932306

IUPAC2-methyl-1-(4-phenylbutan-2-yl)piperazine
SMILESCC(CCc1ccccc1)N1CCNCC1C
InChIInChI=1S/C15H24N2/c1-13(17-11-10-16-12-14(17)2)8-9-15-6-4-3-5-7-15/h3-7,13-14,16H,8-12H2,1-2H3
InChIKeyFACQCRSCAFHVRJ-UHFFFAOYSA-N
MW232.37 g/mol
LogP2.30
Rot. Bonds4

About 2-methyl-1-(4-phenylbutan-2-yl)piperazine

2-methyl-1-(4-phenylbutan-2-yl)piperazine (PubChem CID 64932306) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is 2-methyl-1-(4-phenylbutan-2-yl)piperazine.

Molecular Properties

Compound Name2-methyl-1-(4-phenylbutan-2-yl)piperazine
PubChem CID64932306
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC Name2-methyl-1-(4-phenylbutan-2-yl)piperazine
SMILESCC(CCc1ccccc1)N1CCNCC1C
InChIInChI=1S/C15H24N2/c1-13(17-11-10-16-12-14(17)2)8-9-15-6-4-3-5-7-15/h3-7,13-14,16H,8-12H2,1-2H3
InChIKeyFACQCRSCAFHVRJ-UHFFFAOYSA-N
XLogP2.30
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-2-methyl-1-[(2S)-pentan-2-yl]piperazine
CID 124680628
1-[1-(4-phenylbutan-2-yl)azetidin-3-yl]piperazine
CID 66202032
(3aR,6aS)-5-(4-phenylbutan-2-yl)-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole
CID 114042255
1-(4-phenylbutan-2-yl)piperazin-2-one
CID 64566624
3-[(2S)-2-methylpiperazin-1-yl]butanoic acid
CID 82755213
1-[4-[2-(2-methylpiperazin-1-yl)propoxy]phenyl]-2-phenylhydrazine
CID 155756274
2-methyl-1-(1-thiophen-2-ylpropan-2-yl)piperazine
CID 64930534
(2S)-2-methyl-1-propan-2-ylpiperazine;dihydrochloride
CID 57463733
3-phenyl-1-(2-propan-2-ylpiperazin-1-yl)propan-1-one
CID 82246033
3-benzyl-7-methyl-1-pentan-2-yl-1,4-diazepane
CID 107888724
2-methyl-1-(1-phenylethyl)-1,4-diazepane
CID 82242013
1-(3-phenylpropyl)-2-propan-2-ylpiperazine
CID 64832545

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(4-phenylbutan-2-yl)piperazine?
The IUPAC name of 2-methyl-1-(4-phenylbutan-2-yl)piperazine (CID 64932306) is 2-methyl-1-(4-phenylbutan-2-yl)piperazine.
What is the SMILES notation for 2-methyl-1-(4-phenylbutan-2-yl)piperazine?
The canonical SMILES for 2-methyl-1-(4-phenylbutan-2-yl)piperazine is CC(CCc1ccccc1)N1CCNCC1C.
What is the InChIKey of 2-methyl-1-(4-phenylbutan-2-yl)piperazine?
The InChIKey is FACQCRSCAFHVRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-13(17-11-10-16-12-14(17)2)8-9-15-6-4-3-5-7-15/h3-7,13-14,16H,8-12H2,1-2H3.
What are the key properties of 2-methyl-1-(4-phenylbutan-2-yl)piperazine?
2-methyl-1-(4-phenylbutan-2-yl)piperazine has a molecular weight of 232.37 g/mol, XLogP of 2.30, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(4-phenylbutan-2-yl)piperazine is sourced from PubChem (CID 64932306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).