N-ethyl-N-(phenylselanylmethyl)ethanamine

C11H17NSe — CID 14981210

IUPACN-ethyl-N-(phenylselanylmethyl)ethanamine
SMILESCCN(CC)C[Se]c1ccccc1
InChIInChI=1S/C11H17NSe/c1-3-12(4-2)10-13-11-8-6-5-7-9-11/h5-9H,3-4,10H2,1-2H3
InChIKeyGKYMGLQKETVROL-UHFFFAOYSA-N
MW242.22 g/mol
LogP1.32
Rot. Bonds5

About N-ethyl-N-(phenylselanylmethyl)ethanamine

N-ethyl-N-(phenylselanylmethyl)ethanamine (PubChem CID 14981210) has the molecular formula C11H17NSe and a molecular weight of 242.22 g/mol. Its IUPAC name is N-ethyl-N-(phenylselanylmethyl)ethanamine.

Molecular Properties

Compound NameN-ethyl-N-(phenylselanylmethyl)ethanamine
PubChem CID14981210
Molecular FormulaC11H17NSe
Molecular Weight242.22 g/mol
Exact Mass243.05
IUPAC NameN-ethyl-N-(phenylselanylmethyl)ethanamine
SMILESCCN(CC)C[Se]c1ccccc1
InChIInChI=1S/C11H17NSe/c1-3-12(4-2)10-13-11-8-6-5-7-9-11/h5-9H,3-4,10H2,1-2H3
InChIKeyGKYMGLQKETVROL-UHFFFAOYSA-N
XLogP1.32
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.22
LogP ≤ 51.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(phenylselanylmethyl)ethanamine?
The IUPAC name of N-ethyl-N-(phenylselanylmethyl)ethanamine (CID 14981210) is N-ethyl-N-(phenylselanylmethyl)ethanamine.
What is the SMILES notation for N-ethyl-N-(phenylselanylmethyl)ethanamine?
The canonical SMILES for N-ethyl-N-(phenylselanylmethyl)ethanamine is CCN(CC)C[Se]c1ccccc1.
What is the InChIKey of N-ethyl-N-(phenylselanylmethyl)ethanamine?
The InChIKey is GKYMGLQKETVROL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NSe/c1-3-12(4-2)10-13-11-8-6-5-7-9-11/h5-9H,3-4,10H2,1-2H3.
What are the key properties of N-ethyl-N-(phenylselanylmethyl)ethanamine?
N-ethyl-N-(phenylselanylmethyl)ethanamine has a molecular weight of 242.22 g/mol, XLogP of 1.32, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(phenylselanylmethyl)ethanamine is sourced from PubChem (CID 14981210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).