N-(2-methoxyethyl)-2-phenylethanamine

C11H17NO — CID 17158403

IUPACN-(2-methoxyethyl)-2-phenylethanamine
SMILESCOCCNCCc1ccccc1
InChIInChI=1S/C11H17NO/c1-13-10-9-12-8-7-11-5-3-2-4-6-11/h2-6,12H,7-10H2,1H3
InChIKeyMNWXPJSEFTZSDU-UHFFFAOYSA-N
MW179.26 g/mol
LogP1.47
Rot. Bonds6

About N-(2-methoxyethyl)-2-phenylethanamine

N-(2-methoxyethyl)-2-phenylethanamine (PubChem CID 17158403) has the molecular formula C11H17NO and a molecular weight of 179.26 g/mol. Its IUPAC name is N-(2-methoxyethyl)-2-phenylethanamine.

Molecular Properties

Compound NameN-(2-methoxyethyl)-2-phenylethanamine
PubChem CID17158403
Molecular FormulaC11H17NO
Molecular Weight179.26 g/mol
Exact Mass179.13
IUPAC NameN-(2-methoxyethyl)-2-phenylethanamine
SMILESCOCCNCCc1ccccc1
InChIInChI=1S/C11H17NO/c1-13-10-9-12-8-7-11-5-3-2-4-6-11/h2-6,12H,7-10H2,1H3
InChIKeyMNWXPJSEFTZSDU-UHFFFAOYSA-N
XLogP1.47
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.26
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-2-phenylethanamine?
The IUPAC name of N-(2-methoxyethyl)-2-phenylethanamine (CID 17158403) is N-(2-methoxyethyl)-2-phenylethanamine.
What is the SMILES notation for N-(2-methoxyethyl)-2-phenylethanamine?
The canonical SMILES for N-(2-methoxyethyl)-2-phenylethanamine is COCCNCCc1ccccc1.
What is the InChIKey of N-(2-methoxyethyl)-2-phenylethanamine?
The InChIKey is MNWXPJSEFTZSDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO/c1-13-10-9-12-8-7-11-5-3-2-4-6-11/h2-6,12H,7-10H2,1H3.
What are the key properties of N-(2-methoxyethyl)-2-phenylethanamine?
N-(2-methoxyethyl)-2-phenylethanamine has a molecular weight of 179.26 g/mol, XLogP of 1.47, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-2-phenylethanamine is sourced from PubChem (CID 17158403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).