1-(2-methoxyphenyl)-4-(3-phenylpropyl)piperazine

C20H26N2O — CID 3829509

IUPAC1-(2-methoxyphenyl)-4-(3-phenylpropyl)piperazine
SMILESCOc1ccccc1N1CCN(CCCc2ccccc2)CC1
InChIInChI=1S/C20H26N2O/c1-23-20-12-6-5-11-19(20)22-16-14-21(15-17-22)13-7-10-18-8-3-2-4-9-18/h2-6,8-9,11-12H,7,10,13-17H2,1H3
InChIKeyDSQVFZCPRRLZSA-UHFFFAOYSA-N
MW310.44 g/mol
LogP3.45
Rot. Bonds6

About 1-(2-methoxyphenyl)-4-(3-phenylpropyl)piperazine

1-(2-methoxyphenyl)-4-(3-phenylpropyl)piperazine (PubChem CID 3829509) has the molecular formula C20H26N2O and a molecular weight of 310.44 g/mol. Its IUPAC name is 1-(2-methoxyphenyl)-4-(3-phenylpropyl)piperazine.

Molecular Properties

Compound Name1-(2-methoxyphenyl)-4-(3-phenylpropyl)piperazine
PubChem CID3829509
Molecular FormulaC20H26N2O
Molecular Weight310.44 g/mol
Exact Mass310.20
IUPAC Name1-(2-methoxyphenyl)-4-(3-phenylpropyl)piperazine
SMILESCOc1ccccc1N1CCN(CCCc2ccccc2)CC1
InChIInChI=1S/C20H26N2O/c1-23-20-12-6-5-11-19(20)22-16-14-21(15-17-22)13-7-10-18-8-3-2-4-9-18/h2-6,8-9,11-12H,7,10,13-17H2,1H3
InChIKeyDSQVFZCPRRLZSA-UHFFFAOYSA-N
XLogP3.45
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.44
LogP ≤ 53.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-(2-methoxyphenyl)-4-(3-phenylpropyl)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-methoxyphenyl)-4-(3-phenylpropyl)piperazine?
The IUPAC name of 1-(2-methoxyphenyl)-4-(3-phenylpropyl)piperazine (CID 3829509) is 1-(2-methoxyphenyl)-4-(3-phenylpropyl)piperazine.
What is the SMILES notation for 1-(2-methoxyphenyl)-4-(3-phenylpropyl)piperazine?
The canonical SMILES for 1-(2-methoxyphenyl)-4-(3-phenylpropyl)piperazine is COc1ccccc1N1CCN(CCCc2ccccc2)CC1.
What is the InChIKey of 1-(2-methoxyphenyl)-4-(3-phenylpropyl)piperazine?
The InChIKey is DSQVFZCPRRLZSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O/c1-23-20-12-6-5-11-19(20)22-16-14-21(15-17-22)13-7-10-18-8-3-2-4-9-18/h2-6,8-9,11-12H,7,10,13-17H2,1H3.
What are the key properties of 1-(2-methoxyphenyl)-4-(3-phenylpropyl)piperazine?
1-(2-methoxyphenyl)-4-(3-phenylpropyl)piperazine has a molecular weight of 310.44 g/mol, XLogP of 3.45, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyphenyl)-4-(3-phenylpropyl)piperazine is sourced from PubChem (CID 3829509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).