5-phenyl-2-propan-2-yl-1-(thiophen-2-ylmethyl)piperazine

C18H24N2S — CID 64876116

IUPAC5-phenyl-2-propan-2-yl-1-(thiophen-2-ylmethyl)piperazine
SMILESCC(C)C1CNC(c2ccccc2)CN1Cc1cccs1
InChIInChI=1S/C18H24N2S/c1-14(2)18-11-19-17(15-7-4-3-5-8-15)13-20(18)12-16-9-6-10-21-16/h3-10,14,17-19H,11-13H2,1-2H3
InChIKeyPZPJPYPCFSTMPY-UHFFFAOYSA-N
MW300.47 g/mol
LogP3.92
Rot. Bonds4

About 5-phenyl-2-propan-2-yl-1-(thiophen-2-ylmethyl)piperazine

5-phenyl-2-propan-2-yl-1-(thiophen-2-ylmethyl)piperazine (PubChem CID 64876116) has the molecular formula C18H24N2S and a molecular weight of 300.47 g/mol. Its IUPAC name is 5-phenyl-2-propan-2-yl-1-(thiophen-2-ylmethyl)piperazine.

Molecular Properties

Compound Name5-phenyl-2-propan-2-yl-1-(thiophen-2-ylmethyl)piperazine
PubChem CID64876116
Molecular FormulaC18H24N2S
Molecular Weight300.47 g/mol
Exact Mass300.17
IUPAC Name5-phenyl-2-propan-2-yl-1-(thiophen-2-ylmethyl)piperazine
SMILESCC(C)C1CNC(c2ccccc2)CN1Cc1cccs1
InChIInChI=1S/C18H24N2S/c1-14(2)18-11-19-17(15-7-4-3-5-8-15)13-20(18)12-16-9-6-10-21-16/h3-10,14,17-19H,11-13H2,1-2H3
InChIKeyPZPJPYPCFSTMPY-UHFFFAOYSA-N
XLogP3.92
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.47
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-ethyl-2-propan-2-yl-1-(thiophen-2-ylmethyl)piperazine
CID 64843483
1-(furan-2-ylmethyl)-5-phenyl-2-propan-2-ylpiperazine
CID 64930221
1-(2-methylpentyl)-5-phenyl-2-propan-2-ylpiperazine
CID 64878230
1-benzyl-2-butan-2-yl-5-phenylpiperazine
CID 64877463
2-butan-2-yl-5-propyl-1-(thiophen-2-ylmethyl)piperazine
CID 64839947
1-(3-methoxypropyl)-5-phenyl-2-propan-2-ylpiperazine
CID 64877844
2-butan-2-yl-5-cyclopropyl-1-(thiophen-2-ylmethyl)piperazine
CID 64862427
3-propan-2-yl-2-(thiophen-2-ylmethyl)-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine
CID 79939527
2-methyl-1-(3-methyl-2-propan-2-ylbutyl)-5-phenylpiperazine
CID 102908543
N,N-dimethyl-5-phenyl-2-propan-2-ylpiperazine-1-carboxamide
CID 82248277
(2S,5S)-1-benzyl-5-methyl-2-propan-2-ylpiperazine
CID 46705371
5,5-dimethyl-2-phenyl-1-(thiophen-2-ylmethyl)piperazine
CID 64840285

Frequently Asked Questions

What is the IUPAC name of 5-phenyl-2-propan-2-yl-1-(thiophen-2-ylmethyl)piperazine?
The IUPAC name of 5-phenyl-2-propan-2-yl-1-(thiophen-2-ylmethyl)piperazine (CID 64876116) is 5-phenyl-2-propan-2-yl-1-(thiophen-2-ylmethyl)piperazine.
What is the SMILES notation for 5-phenyl-2-propan-2-yl-1-(thiophen-2-ylmethyl)piperazine?
The canonical SMILES for 5-phenyl-2-propan-2-yl-1-(thiophen-2-ylmethyl)piperazine is CC(C)C1CNC(c2ccccc2)CN1Cc1cccs1.
What is the InChIKey of 5-phenyl-2-propan-2-yl-1-(thiophen-2-ylmethyl)piperazine?
The InChIKey is PZPJPYPCFSTMPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2S/c1-14(2)18-11-19-17(15-7-4-3-5-8-15)13-20(18)12-16-9-6-10-21-16/h3-10,14,17-19H,11-13H2,1-2H3.
What are the key properties of 5-phenyl-2-propan-2-yl-1-(thiophen-2-ylmethyl)piperazine?
5-phenyl-2-propan-2-yl-1-(thiophen-2-ylmethyl)piperazine has a molecular weight of 300.47 g/mol, XLogP of 3.92, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-phenyl-2-propan-2-yl-1-(thiophen-2-ylmethyl)piperazine is sourced from PubChem (CID 64876116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).