5-ethyl-1-phenyl-2-propan-2-ylpiperazine

C15H24N2 — CID 64930277

IUPAC5-ethyl-1-phenyl-2-propan-2-ylpiperazine
SMILESCCC1CN(c2ccccc2)C(C(C)C)CN1
InChIInChI=1S/C15H24N2/c1-4-13-11-17(14-8-6-5-7-9-14)15(10-16-13)12(2)3/h5-9,12-13,15-16H,4,10-11H2,1-3H3
InChIKeyMQKMWWILOOQVKR-UHFFFAOYSA-N
MW232.37 g/mol
LogP2.90
Rot. Bonds3

About 5-ethyl-1-phenyl-2-propan-2-ylpiperazine

5-ethyl-1-phenyl-2-propan-2-ylpiperazine (PubChem CID 64930277) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is 5-ethyl-1-phenyl-2-propan-2-ylpiperazine.

Molecular Properties

Compound Name5-ethyl-1-phenyl-2-propan-2-ylpiperazine
PubChem CID64930277
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC Name5-ethyl-1-phenyl-2-propan-2-ylpiperazine
SMILESCCC1CN(c2ccccc2)C(C(C)C)CN1
InChIInChI=1S/C15H24N2/c1-4-13-11-17(14-8-6-5-7-9-14)15(10-16-13)12(2)3/h5-9,12-13,15-16H,4,10-11H2,1-3H3
InChIKeyMQKMWWILOOQVKR-UHFFFAOYSA-N
XLogP2.90
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-1-phenyl-2-propan-2-ylpiperazine?
The IUPAC name of 5-ethyl-1-phenyl-2-propan-2-ylpiperazine (CID 64930277) is 5-ethyl-1-phenyl-2-propan-2-ylpiperazine.
What is the SMILES notation for 5-ethyl-1-phenyl-2-propan-2-ylpiperazine?
The canonical SMILES for 5-ethyl-1-phenyl-2-propan-2-ylpiperazine is CCC1CN(c2ccccc2)C(C(C)C)CN1.
What is the InChIKey of 5-ethyl-1-phenyl-2-propan-2-ylpiperazine?
The InChIKey is MQKMWWILOOQVKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-4-13-11-17(14-8-6-5-7-9-14)15(10-16-13)12(2)3/h5-9,12-13,15-16H,4,10-11H2,1-3H3.
What are the key properties of 5-ethyl-1-phenyl-2-propan-2-ylpiperazine?
5-ethyl-1-phenyl-2-propan-2-ylpiperazine has a molecular weight of 232.37 g/mol, XLogP of 2.90, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-1-phenyl-2-propan-2-ylpiperazine is sourced from PubChem (CID 64930277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).