2,5-dimethyl-1-(2-methylpropyl)-2-phenylpiperazine

C16H26N2 — CID 64843969

IUPAC2,5-dimethyl-1-(2-methylpropyl)-2-phenylpiperazine
SMILESCC(C)CN1CC(C)NCC1(C)c1ccccc1
InChIInChI=1S/C16H26N2/c1-13(2)10-18-11-14(3)17-12-16(18,4)15-8-6-5-7-9-15/h5-9,13-14,17H,10-12H2,1-4H3
InChIKeyPLXQNFVZVCYDNQ-UHFFFAOYSA-N
MW246.40 g/mol
LogP2.85
Rot. Bonds3

About 2,5-dimethyl-1-(2-methylpropyl)-2-phenylpiperazine

2,5-dimethyl-1-(2-methylpropyl)-2-phenylpiperazine (PubChem CID 64843969) has the molecular formula C16H26N2 and a molecular weight of 246.40 g/mol. Its IUPAC name is 2,5-dimethyl-1-(2-methylpropyl)-2-phenylpiperazine.

Molecular Properties

Compound Name2,5-dimethyl-1-(2-methylpropyl)-2-phenylpiperazine
PubChem CID64843969
Molecular FormulaC16H26N2
Molecular Weight246.40 g/mol
Exact Mass246.21
IUPAC Name2,5-dimethyl-1-(2-methylpropyl)-2-phenylpiperazine
SMILESCC(C)CN1CC(C)NCC1(C)c1ccccc1
InChIInChI=1S/C16H26N2/c1-13(2)10-18-11-14(3)17-12-16(18,4)15-8-6-5-7-9-15/h5-9,13-14,17H,10-12H2,1-4H3
InChIKeyPLXQNFVZVCYDNQ-UHFFFAOYSA-N
XLogP2.85
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.40
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-1-(2-methylpropyl)-2-phenyl-5-propylpiperazine
CID 64838442
2,5-dimethyl-2-phenyl-1-prop-2-enylpiperazine
CID 64844166
2,5-dimethyl-2-phenyl-1-(2,2,2-trifluoroethyl)piperazine
CID 64845157
2,5-dimethyl-1-pentyl-2-phenylpiperazine
CID 64845156
1-(3-fluoropropyl)-2,5-dimethyl-2-phenylpiperazine
CID 81113703
1-(3,3-dimethylbutyl)-2,5-dimethyl-2-phenylpiperazine
CID 64845546
1-(3-methoxypropyl)-2,5-dimethyl-2-phenylpiperazine
CID 64846932
1-[(E)-3-chloro-2-methylprop-2-enyl]-2,5-dimethyl-2-phenylpiperazine
CID 106440345
2,5-dimethyl-2-phenyl-1-(4,4,4-trifluorobutyl)piperazine
CID 115518790
1-(4-methoxybutyl)-2,5-dimethyl-2-phenylpiperazine
CID 104650161
1-butyl-2-methyl-5-(2-methylpropyl)-2-phenylpiperazine
CID 64847619
1-(2-fluoroethyl)-2-methyl-2-phenyl-5-propan-2-ylpiperazine
CID 80697269

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-1-(2-methylpropyl)-2-phenylpiperazine?
The IUPAC name of 2,5-dimethyl-1-(2-methylpropyl)-2-phenylpiperazine (CID 64843969) is 2,5-dimethyl-1-(2-methylpropyl)-2-phenylpiperazine.
What is the SMILES notation for 2,5-dimethyl-1-(2-methylpropyl)-2-phenylpiperazine?
The canonical SMILES for 2,5-dimethyl-1-(2-methylpropyl)-2-phenylpiperazine is CC(C)CN1CC(C)NCC1(C)c1ccccc1.
What is the InChIKey of 2,5-dimethyl-1-(2-methylpropyl)-2-phenylpiperazine?
The InChIKey is PLXQNFVZVCYDNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2/c1-13(2)10-18-11-14(3)17-12-16(18,4)15-8-6-5-7-9-15/h5-9,13-14,17H,10-12H2,1-4H3.
What are the key properties of 2,5-dimethyl-1-(2-methylpropyl)-2-phenylpiperazine?
2,5-dimethyl-1-(2-methylpropyl)-2-phenylpiperazine has a molecular weight of 246.40 g/mol, XLogP of 2.85, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-1-(2-methylpropyl)-2-phenylpiperazine is sourced from PubChem (CID 64843969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).