1-(3-naphthalen-2-ylpropyl)-4-phenylpiperazine

C23H26N2 — CID 15723897

IUPAC1-(3-naphthalen-2-ylpropyl)-4-phenylpiperazine
SMILESc1ccc(N2CCN(CCCc3ccc4ccccc4c3)CC2)cc1
InChIInChI=1S/C23H26N2/c1-2-10-23(11-3-1)25-17-15-24(16-18-25)14-6-7-20-12-13-21-8-4-5-9-22(21)19-20/h1-5,8-13,19H,6-7,14-18H2
InChIKeyZDMWBBFQNAAKPP-UHFFFAOYSA-N
MW330.48 g/mol
LogP4.59
Rot. Bonds5

About 1-(3-naphthalen-2-ylpropyl)-4-phenylpiperazine

1-(3-naphthalen-2-ylpropyl)-4-phenylpiperazine (PubChem CID 15723897) has the molecular formula C23H26N2 and a molecular weight of 330.48 g/mol. Its IUPAC name is 1-(3-naphthalen-2-ylpropyl)-4-phenylpiperazine.

Molecular Properties

Compound Name1-(3-naphthalen-2-ylpropyl)-4-phenylpiperazine
PubChem CID15723897
Molecular FormulaC23H26N2
Molecular Weight330.48 g/mol
Exact Mass330.21
IUPAC Name1-(3-naphthalen-2-ylpropyl)-4-phenylpiperazine
SMILESc1ccc(N2CCN(CCCc3ccc4ccccc4c3)CC2)cc1
InChIInChI=1S/C23H26N2/c1-2-10-23(11-3-1)25-17-15-24(16-18-25)14-6-7-20-12-13-21-8-4-5-9-22(21)19-20/h1-5,8-13,19H,6-7,14-18H2
InChIKeyZDMWBBFQNAAKPP-UHFFFAOYSA-N
XLogP4.59
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.48
LogP ≤ 54.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(3-naphthalen-2-ylpropyl)-4-phenylpiperazine?
The IUPAC name of 1-(3-naphthalen-2-ylpropyl)-4-phenylpiperazine (CID 15723897) is 1-(3-naphthalen-2-ylpropyl)-4-phenylpiperazine.
What is the SMILES notation for 1-(3-naphthalen-2-ylpropyl)-4-phenylpiperazine?
The canonical SMILES for 1-(3-naphthalen-2-ylpropyl)-4-phenylpiperazine is c1ccc(N2CCN(CCCc3ccc4ccccc4c3)CC2)cc1.
What is the InChIKey of 1-(3-naphthalen-2-ylpropyl)-4-phenylpiperazine?
The InChIKey is ZDMWBBFQNAAKPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N2/c1-2-10-23(11-3-1)25-17-15-24(16-18-25)14-6-7-20-12-13-21-8-4-5-9-22(21)19-20/h1-5,8-13,19H,6-7,14-18H2.
What are the key properties of 1-(3-naphthalen-2-ylpropyl)-4-phenylpiperazine?
1-(3-naphthalen-2-ylpropyl)-4-phenylpiperazine has a molecular weight of 330.48 g/mol, XLogP of 4.59, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-naphthalen-2-ylpropyl)-4-phenylpiperazine is sourced from PubChem (CID 15723897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).