(2S)-2-(phenylmethoxymethyl)-1-[(2-phenylselanylphenyl)methyl]pyrrolidine

Name: (2S)-2-(phenylmethoxymethyl)-1-[(2-phenylselanylphenyl)methyl]pyrrolidine — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₂₅H₂₇NOSe — CID 15385624

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPAC(2S)-2-(phenylmethoxymethyl)-1-[(2-phenylselanylphenyl)methyl]pyrrolidine

SMILESc1ccc(COC[C@@H]2CCCN2Cc2ccccc2[Se]c2ccccc2)cc1

InChIInChI=1S/C25H27NOSe/c1-3-10-21(11-4-1)19-27-20-23-13-9-17-26(23)18-22-12-7-8-16-25(22)28-24-14-5-2-6-15-24/h1-8,10-12,14-16,23H,9,13,17-20H2/t23-/m0/s1

InChIKeyRLLJVMYWFUIAEG-QHCPKHFHSA-N

MW436.46 g/mol

LogP3.52

Rot. Bonds8

About (2S)-2-(phenylmethoxymethyl)-1-[(2-phenylselanylphenyl)methyl]pyrrolidine

(2S)-2-(phenylmethoxymethyl)-1-[(2-phenylselanylphenyl)methyl]pyrrolidine (PubChem CID 15385624) has the molecular formula C₂₅H₂₇NOSe and a molecular weight of 436.46 g/mol. Its IUPAC name is (2S)-2-(phenylmethoxymethyl)-1-[(2-phenylselanylphenyl)methyl]pyrrolidine.

Molecular Properties

Compound Name	(2S)-2-(phenylmethoxymethyl)-1-[(2-phenylselanylphenyl)methyl]pyrrolidine
PubChem CID	15385624
Molecular Formula	C₂₅H₂₇NOSe
Molecular Weight	436.46 g/mol
Exact Mass	437.13
IUPAC Name	(2S)-2-(phenylmethoxymethyl)-1-[(2-phenylselanylphenyl)methyl]pyrrolidine
SMILES	c1ccc(COC[C@@H]2CCCN2Cc2ccccc2[Se]c2ccccc2)cc1
InChI	InChI=1S/C25H27NOSe/c1-3-10-21(11-4-1)19-27-20-23-13-9-17-26(23)18-22-12-7-8-16-25(22)28-24-14-5-2-6-15-24/h1-8,10-12,14-16,23H,9,13,17-20H2/t23-/m0/s1
InChIKey	RLLJVMYWFUIAEG-QHCPKHFHSA-N
XLogP	3.52
TPSA	12.47 Å²
H-Bond Donors
H-Bond Acceptors	2
Rotatable Bonds	8
Heavy Atoms	28
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	436.46
LogP ≤ 5	3.52
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	2

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of (2S)-2-(phenylmethoxymethyl)-1-[(2-phenylselanylphenyl)methyl]pyrrolidine?

The IUPAC name of (2S)-2-(phenylmethoxymethyl)-1-[(2-phenylselanylphenyl)methyl]pyrrolidine (CID 15385624) is (2S)-2-(phenylmethoxymethyl)-1-[(2-phenylselanylphenyl)methyl]pyrrolidine.

What is the SMILES notation for (2S)-2-(phenylmethoxymethyl)-1-[(2-phenylselanylphenyl)methyl]pyrrolidine?

The canonical SMILES for (2S)-2-(phenylmethoxymethyl)-1-[(2-phenylselanylphenyl)methyl]pyrrolidine is c1ccc(COC[C@@H]2CCCN2Cc2ccccc2[Se]c2ccccc2)cc1.

What is the InChIKey of (2S)-2-(phenylmethoxymethyl)-1-[(2-phenylselanylphenyl)methyl]pyrrolidine?

The InChIKey is RLLJVMYWFUIAEG-QHCPKHFHSA-N. The full InChI is InChI=1S/C25H27NOSe/c1-3-10-21(11-4-1)19-27-20-23-13-9-17-26(23)18-22-12-7-8-16-25(22)28-24-14-5-2-6-15-24/h1-8,10-12,14-16,23H,9,13,17-20H2/t23-/m0/s1.

What are the key properties of (2S)-2-(phenylmethoxymethyl)-1-[(2-phenylselanylphenyl)methyl]pyrrolidine?

(2S)-2-(phenylmethoxymethyl)-1-[(2-phenylselanylphenyl)methyl]pyrrolidine has a molecular weight of 436.46 g/mol, XLogP of 3.52, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for (2S)-2-(phenylmethoxymethyl)-1-[(2-phenylselanylphenyl)methyl]pyrrolidine is sourced from PubChem (CID 15385624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 15385624 — identifiers, structure, computed properties (public domain)

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