1-(2-ethoxyphenyl)-4-(naphthalen-1-ylmethyl)piperazine

C23H26N2O — CID 792265

IUPAC1-(2-ethoxyphenyl)-4-(naphthalen-1-ylmethyl)piperazine
SMILESCCOc1ccccc1N1CCN(Cc2cccc3ccccc23)CC1
InChIInChI=1S/C23H26N2O/c1-2-26-23-13-6-5-12-22(23)25-16-14-24(15-17-25)18-20-10-7-9-19-8-3-4-11-21(19)20/h3-13H,2,14-18H2,1H3
InChIKeyYPOPWNSAWBPGOR-UHFFFAOYSA-N
MW346.47 g/mol
LogP4.56
Rot. Bonds5

About 1-(2-ethoxyphenyl)-4-(naphthalen-1-ylmethyl)piperazine

1-(2-ethoxyphenyl)-4-(naphthalen-1-ylmethyl)piperazine (PubChem CID 792265) has the molecular formula C23H26N2O and a molecular weight of 346.47 g/mol. Its IUPAC name is 1-(2-ethoxyphenyl)-4-(naphthalen-1-ylmethyl)piperazine.

Molecular Properties

Compound Name1-(2-ethoxyphenyl)-4-(naphthalen-1-ylmethyl)piperazine
PubChem CID792265
Molecular FormulaC23H26N2O
Molecular Weight346.47 g/mol
Exact Mass346.20
IUPAC Name1-(2-ethoxyphenyl)-4-(naphthalen-1-ylmethyl)piperazine
SMILESCCOc1ccccc1N1CCN(Cc2cccc3ccccc23)CC1
InChIInChI=1S/C23H26N2O/c1-2-26-23-13-6-5-12-22(23)25-16-14-24(15-17-25)18-20-10-7-9-19-8-3-4-11-21(19)20/h3-13H,2,14-18H2,1H3
InChIKeyYPOPWNSAWBPGOR-UHFFFAOYSA-N
XLogP4.56
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.47
LogP ≤ 54.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-(2-ethoxyphenyl)-4-(naphthalen-1-ylmethyl)piperazine 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-(2-ethoxyphenyl)-4-(naphthalen-1-ylmethyl)piperazine?
The IUPAC name of 1-(2-ethoxyphenyl)-4-(naphthalen-1-ylmethyl)piperazine (CID 792265) is 1-(2-ethoxyphenyl)-4-(naphthalen-1-ylmethyl)piperazine.
What is the SMILES notation for 1-(2-ethoxyphenyl)-4-(naphthalen-1-ylmethyl)piperazine?
The canonical SMILES for 1-(2-ethoxyphenyl)-4-(naphthalen-1-ylmethyl)piperazine is CCOc1ccccc1N1CCN(Cc2cccc3ccccc23)CC1.
What is the InChIKey of 1-(2-ethoxyphenyl)-4-(naphthalen-1-ylmethyl)piperazine?
The InChIKey is YPOPWNSAWBPGOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N2O/c1-2-26-23-13-6-5-12-22(23)25-16-14-24(15-17-25)18-20-10-7-9-19-8-3-4-11-21(19)20/h3-13H,2,14-18H2,1H3.
What are the key properties of 1-(2-ethoxyphenyl)-4-(naphthalen-1-ylmethyl)piperazine?
1-(2-ethoxyphenyl)-4-(naphthalen-1-ylmethyl)piperazine has a molecular weight of 346.47 g/mol, XLogP of 4.56, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethoxyphenyl)-4-(naphthalen-1-ylmethyl)piperazine is sourced from PubChem (CID 792265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).