1-[(1R)-1-phenylethyl]-4-propan-2-ylpiperazine

C15H24N2 — CID 134380011

IUPAC1-[(1R)-1-phenylethyl]-4-propan-2-ylpiperazine
SMILESCC(C)N1CCN([C@H](C)c2ccccc2)CC1
InChIInChI=1S/C15H24N2/c1-13(2)16-9-11-17(12-10-16)14(3)15-7-5-4-6-8-15/h4-8,13-14H,9-12H2,1-3H3/t14-/m1/s1
InChIKeyLMUOEXBZUBOWNP-CQSZACIVSA-N
MW232.37 g/mol
LogP2.77
Rot. Bonds3

About 1-[(1R)-1-phenylethyl]-4-propan-2-ylpiperazine

1-[(1R)-1-phenylethyl]-4-propan-2-ylpiperazine (PubChem CID 134380011) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is 1-[(1R)-1-phenylethyl]-4-propan-2-ylpiperazine.

Molecular Properties

Compound Name1-[(1R)-1-phenylethyl]-4-propan-2-ylpiperazine
PubChem CID134380011
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC Name1-[(1R)-1-phenylethyl]-4-propan-2-ylpiperazine
SMILESCC(C)N1CCN([C@H](C)c2ccccc2)CC1
InChIInChI=1S/C15H24N2/c1-13(2)16-9-11-17(12-10-16)14(3)15-7-5-4-6-8-15/h4-8,13-14H,9-12H2,1-3H3/t14-/m1/s1
InChIKeyLMUOEXBZUBOWNP-CQSZACIVSA-N
XLogP2.77
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 52.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-[(1R)-1-phenylethyl]-4-propan-2-ylpiperazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-[(1R)-1-phenylethyl]-4-propan-2-ylpiperazine?
The IUPAC name of 1-[(1R)-1-phenylethyl]-4-propan-2-ylpiperazine (CID 134380011) is 1-[(1R)-1-phenylethyl]-4-propan-2-ylpiperazine.
What is the SMILES notation for 1-[(1R)-1-phenylethyl]-4-propan-2-ylpiperazine?
The canonical SMILES for 1-[(1R)-1-phenylethyl]-4-propan-2-ylpiperazine is CC(C)N1CCN([C@H](C)c2ccccc2)CC1.
What is the InChIKey of 1-[(1R)-1-phenylethyl]-4-propan-2-ylpiperazine?
The InChIKey is LMUOEXBZUBOWNP-CQSZACIVSA-N. The full InChI is InChI=1S/C15H24N2/c1-13(2)16-9-11-17(12-10-16)14(3)15-7-5-4-6-8-15/h4-8,13-14H,9-12H2,1-3H3/t14-/m1/s1.
What are the key properties of 1-[(1R)-1-phenylethyl]-4-propan-2-ylpiperazine?
1-[(1R)-1-phenylethyl]-4-propan-2-ylpiperazine has a molecular weight of 232.37 g/mol, XLogP of 2.77, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1R)-1-phenylethyl]-4-propan-2-ylpiperazine is sourced from PubChem (CID 134380011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).