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

C17H28N2 — CID 64935365

IUPAC1-(2,2-dimethylpropyl)-2,5-dimethyl-5-phenylpiperazine
SMILESCC1CNC(C)(c2ccccc2)CN1CC(C)(C)C
InChIInChI=1S/C17H28N2/c1-14-11-18-17(5,15-9-7-6-8-10-15)13-19(14)12-16(2,3)4/h6-10,14,18H,11-13H2,1-5H3
InChIKeyLNNRUWMAYGJDRL-UHFFFAOYSA-N
MW260.43 g/mol
LogP3.24
Rot. Bonds2

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

1-(2,2-dimethylpropyl)-2,5-dimethyl-5-phenylpiperazine (PubChem CID 64935365) has the molecular formula C17H28N2 and a molecular weight of 260.43 g/mol. Its IUPAC name is 1-(2,2-dimethylpropyl)-2,5-dimethyl-5-phenylpiperazine.

Molecular Properties

Compound Name1-(2,2-dimethylpropyl)-2,5-dimethyl-5-phenylpiperazine
PubChem CID64935365
Molecular FormulaC17H28N2
Molecular Weight260.43 g/mol
Exact Mass260.23
IUPAC Name1-(2,2-dimethylpropyl)-2,5-dimethyl-5-phenylpiperazine
SMILESCC1CNC(C)(c2ccccc2)CN1CC(C)(C)C
InChIInChI=1S/C17H28N2/c1-14-11-18-17(5,15-9-7-6-8-10-15)13-19(14)12-16(2,3)4/h6-10,14,18H,11-13H2,1-5H3
InChIKeyLNNRUWMAYGJDRL-UHFFFAOYSA-N
XLogP3.24
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.43
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-methoxyethyl)-2,5-dimethyl-5-phenylpiperazine
CID 64861931
2,5-dimethyl-5-phenyl-1-(thiophen-3-ylmethyl)piperazine
CID 64862285
1-hex-5-ynyl-2,5-dimethyl-5-phenylpiperazine
CID 106211786
5-[(2,5-dimethyl-5-phenylpiperazin-1-yl)methyl]-4-methyl-1,3-thiazole
CID 64940420
1-(2,2-dimethylpropyl)-3-methyl-3-phenylpiperazine
CID 64925313
2-tert-butyl-1-(2,2-difluoroethyl)-5-methyl-5-phenylpiperazine
CID 64861149
1-ethyl-5-methyl-5-phenyl-2-propylpiperazine
CID 64862477
1-hexan-3-yl-2,5-dimethyl-5-phenylpiperazine
CID 64947170
1-(1-cyclopropylbutan-2-yl)-2,5-dimethyl-5-phenylpiperazine
CID 64941245
1-but-3-en-2-yl-2,5-dimethyl-5-phenylpiperazine
CID 113480602
2-cyclopropyl-5-methyl-5-phenyl-1-propylpiperazine
CID 64860974
1-benzyl-3,7-dimethyl-3-phenyl-1,4-diazepane
CID 64870439

Frequently Asked Questions

What is the IUPAC name of 1-(2,2-dimethylpropyl)-2,5-dimethyl-5-phenylpiperazine?
The IUPAC name of 1-(2,2-dimethylpropyl)-2,5-dimethyl-5-phenylpiperazine (CID 64935365) is 1-(2,2-dimethylpropyl)-2,5-dimethyl-5-phenylpiperazine.
What is the SMILES notation for 1-(2,2-dimethylpropyl)-2,5-dimethyl-5-phenylpiperazine?
The canonical SMILES for 1-(2,2-dimethylpropyl)-2,5-dimethyl-5-phenylpiperazine is CC1CNC(C)(c2ccccc2)CN1CC(C)(C)C.
What is the InChIKey of 1-(2,2-dimethylpropyl)-2,5-dimethyl-5-phenylpiperazine?
The InChIKey is LNNRUWMAYGJDRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2/c1-14-11-18-17(5,15-9-7-6-8-10-15)13-19(14)12-16(2,3)4/h6-10,14,18H,11-13H2,1-5H3.
What are the key properties of 1-(2,2-dimethylpropyl)-2,5-dimethyl-5-phenylpiperazine?
1-(2,2-dimethylpropyl)-2,5-dimethyl-5-phenylpiperazine has a molecular weight of 260.43 g/mol, XLogP of 3.24, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-dimethylpropyl)-2,5-dimethyl-5-phenylpiperazine is sourced from PubChem (CID 64935365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).