3-benzyl-1-(2-phenylethyl)piperazine

C19H24N2 — CID 64832904

IUPAC3-benzyl-1-(2-phenylethyl)piperazine
SMILESc1ccc(CCN2CCNC(Cc3ccccc3)C2)cc1
InChIInChI=1S/C19H24N2/c1-3-7-17(8-4-1)11-13-21-14-12-20-19(16-21)15-18-9-5-2-6-10-18/h1-10,19-20H,11-16H2
InChIKeyOTNPETPULUEIMF-UHFFFAOYSA-N
MW280.42 g/mol
LogP2.75
Rot. Bonds5

About 3-benzyl-1-(2-phenylethyl)piperazine

3-benzyl-1-(2-phenylethyl)piperazine (PubChem CID 64832904) has the molecular formula C19H24N2 and a molecular weight of 280.42 g/mol. Its IUPAC name is 3-benzyl-1-(2-phenylethyl)piperazine.

Molecular Properties

Compound Name3-benzyl-1-(2-phenylethyl)piperazine
PubChem CID64832904
Molecular FormulaC19H24N2
Molecular Weight280.42 g/mol
Exact Mass280.19
IUPAC Name3-benzyl-1-(2-phenylethyl)piperazine
SMILESc1ccc(CCN2CCNC(Cc3ccccc3)C2)cc1
InChIInChI=1S/C19H24N2/c1-3-7-17(8-4-1)11-13-21-14-12-20-19(16-21)15-18-9-5-2-6-10-18/h1-10,19-20H,11-16H2
InChIKeyOTNPETPULUEIMF-UHFFFAOYSA-N
XLogP2.75
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.42
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-benzyl-1-octylpiperazine
CID 64833102
(3S)-3-methyl-1-(2-phenylethyl)piperazine
CID 95243884
3-benzyl-1-(2-methylpropyl)piperazine
CID 64833907
1-benzyl-3-[(4-fluorophenyl)methyl]piperazine
CID 18703475
[4-(2-phenylethyl)-1,4-diazepan-2-yl]methanol
CID 82243271
3-benzyl-1-[(E)-but-2-enyl]piperazine
CID 107897866
3-benzyl-1-[(2-methylphenyl)methyl]piperazine
CID 64834107
3-benzyl-1-(2-methoxyethyl)-1,4-diazepane
CID 64858991
3-benzyl-1-(2-cyclopentylethyl)-1,4-diazepane
CID 64945183
3-benzyl-1-(furan-2-ylmethyl)piperazine
CID 64924799
4-[[(2R)-4-benzylpiperazin-2-yl]methyl]benzonitrile
CID 59325125
4-[(3-benzylpiperazin-1-yl)methyl]benzoic acid
CID 53414066

Frequently Asked Questions

What is the IUPAC name of 3-benzyl-1-(2-phenylethyl)piperazine?
The IUPAC name of 3-benzyl-1-(2-phenylethyl)piperazine (CID 64832904) is 3-benzyl-1-(2-phenylethyl)piperazine.
What is the SMILES notation for 3-benzyl-1-(2-phenylethyl)piperazine?
The canonical SMILES for 3-benzyl-1-(2-phenylethyl)piperazine is c1ccc(CCN2CCNC(Cc3ccccc3)C2)cc1.
What is the InChIKey of 3-benzyl-1-(2-phenylethyl)piperazine?
The InChIKey is OTNPETPULUEIMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2/c1-3-7-17(8-4-1)11-13-21-14-12-20-19(16-21)15-18-9-5-2-6-10-18/h1-10,19-20H,11-16H2.
What are the key properties of 3-benzyl-1-(2-phenylethyl)piperazine?
3-benzyl-1-(2-phenylethyl)piperazine has a molecular weight of 280.42 g/mol, XLogP of 2.75, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-benzyl-1-(2-phenylethyl)piperazine is sourced from PubChem (CID 64832904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).