1-(1-benzoselenophen-2-yl)piperidine

C13H15NSe — CID 134159684

IUPAC1-(1-benzoselenophen-2-yl)piperidine
SMILESc1ccc2[se]c(N3CCCCC3)cc2c1
InChIInChI=1S/C13H15NSe/c1-4-8-14(9-5-1)13-10-11-6-2-3-7-12(11)15-13/h2-3,6-7,10H,1,4-5,8-9H2
InChIKeyWQTPZJQIRKPQOQ-UHFFFAOYSA-N
MW264.23 g/mol
LogP2.89
Rot. Bonds1

About 1-(1-benzoselenophen-2-yl)piperidine

1-(1-benzoselenophen-2-yl)piperidine (PubChem CID 134159684) has the molecular formula C13H15NSe and a molecular weight of 264.23 g/mol. Its IUPAC name is 1-(1-benzoselenophen-2-yl)piperidine.

Molecular Properties

Compound Name1-(1-benzoselenophen-2-yl)piperidine
PubChem CID134159684
Molecular FormulaC13H15NSe
Molecular Weight264.23 g/mol
Exact Mass265.04
IUPAC Name1-(1-benzoselenophen-2-yl)piperidine
SMILESc1ccc2[se]c(N3CCCCC3)cc2c1
InChIInChI=1S/C13H15NSe/c1-4-8-14(9-5-1)13-10-11-6-2-3-7-12(11)15-13/h2-3,6-7,10H,1,4-5,8-9H2
InChIKeyWQTPZJQIRKPQOQ-UHFFFAOYSA-N
XLogP2.89
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.23
LogP ≤ 52.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze 1-(1-benzoselenophen-2-yl)piperidine 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-(1-benzoselenophen-2-yl)piperidine?
The IUPAC name of 1-(1-benzoselenophen-2-yl)piperidine (CID 134159684) is 1-(1-benzoselenophen-2-yl)piperidine.
What is the SMILES notation for 1-(1-benzoselenophen-2-yl)piperidine?
The canonical SMILES for 1-(1-benzoselenophen-2-yl)piperidine is c1ccc2[se]c(N3CCCCC3)cc2c1.
What is the InChIKey of 1-(1-benzoselenophen-2-yl)piperidine?
The InChIKey is WQTPZJQIRKPQOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NSe/c1-4-8-14(9-5-1)13-10-11-6-2-3-7-12(11)15-13/h2-3,6-7,10H,1,4-5,8-9H2.
What are the key properties of 1-(1-benzoselenophen-2-yl)piperidine?
1-(1-benzoselenophen-2-yl)piperidine has a molecular weight of 264.23 g/mol, XLogP of 2.89, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-benzoselenophen-2-yl)piperidine is sourced from PubChem (CID 134159684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).