(1R)-N-[2-(2-methoxyethoxy)ethyl]-1-phenyl-2-piperidin-1-ylethanamine

C18H30N2O2 — CID 10380812

IUPAC(1R)-N-[2-(2-methoxyethoxy)ethyl]-1-phenyl-2-piperidin-1-ylethanamine
SMILESCOCCOCCN[C@@H](CN1CCCCC1)c1ccccc1
InChIInChI=1S/C18H30N2O2/c1-21-14-15-22-13-10-19-18(17-8-4-2-5-9-17)16-20-11-6-3-7-12-20/h2,4-5,8-9,18-19H,3,6-7,10-16H2,1H3/t18-/m0/s1
InChIKeyIQQZFEUQIJNMIB-SFHVURJKSA-N
MW306.45 g/mol
LogP2.47
Rot. Bonds10

About (1R)-N-[2-(2-methoxyethoxy)ethyl]-1-phenyl-2-piperidin-1-ylethanamine

(1R)-N-[2-(2-methoxyethoxy)ethyl]-1-phenyl-2-piperidin-1-ylethanamine (PubChem CID 10380812) has the molecular formula C18H30N2O2 and a molecular weight of 306.45 g/mol. Its IUPAC name is (1R)-N-[2-(2-methoxyethoxy)ethyl]-1-phenyl-2-piperidin-1-ylethanamine.

Molecular Properties

Compound Name(1R)-N-[2-(2-methoxyethoxy)ethyl]-1-phenyl-2-piperidin-1-ylethanamine
PubChem CID10380812
Molecular FormulaC18H30N2O2
Molecular Weight306.45 g/mol
Exact Mass306.23
IUPAC Name(1R)-N-[2-(2-methoxyethoxy)ethyl]-1-phenyl-2-piperidin-1-ylethanamine
SMILESCOCCOCCN[C@@H](CN1CCCCC1)c1ccccc1
InChIInChI=1S/C18H30N2O2/c1-21-14-15-22-13-10-19-18(17-8-4-2-5-9-17)16-20-11-6-3-7-12-20/h2,4-5,8-9,18-19H,3,6-7,10-16H2,1H3/t18-/m0/s1
InChIKeyIQQZFEUQIJNMIB-SFHVURJKSA-N
XLogP2.47
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.45
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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 (1R)-N-[2-(2-methoxyethoxy)ethyl]-1-phenyl-2-piperidin-1-ylethanamine?
The IUPAC name of (1R)-N-[2-(2-methoxyethoxy)ethyl]-1-phenyl-2-piperidin-1-ylethanamine (CID 10380812) is (1R)-N-[2-(2-methoxyethoxy)ethyl]-1-phenyl-2-piperidin-1-ylethanamine.
What is the SMILES notation for (1R)-N-[2-(2-methoxyethoxy)ethyl]-1-phenyl-2-piperidin-1-ylethanamine?
The canonical SMILES for (1R)-N-[2-(2-methoxyethoxy)ethyl]-1-phenyl-2-piperidin-1-ylethanamine is COCCOCCN[C@@H](CN1CCCCC1)c1ccccc1.
What is the InChIKey of (1R)-N-[2-(2-methoxyethoxy)ethyl]-1-phenyl-2-piperidin-1-ylethanamine?
The InChIKey is IQQZFEUQIJNMIB-SFHVURJKSA-N. The full InChI is InChI=1S/C18H30N2O2/c1-21-14-15-22-13-10-19-18(17-8-4-2-5-9-17)16-20-11-6-3-7-12-20/h2,4-5,8-9,18-19H,3,6-7,10-16H2,1H3/t18-/m0/s1.
What are the key properties of (1R)-N-[2-(2-methoxyethoxy)ethyl]-1-phenyl-2-piperidin-1-ylethanamine?
(1R)-N-[2-(2-methoxyethoxy)ethyl]-1-phenyl-2-piperidin-1-ylethanamine has a molecular weight of 306.45 g/mol, XLogP of 2.47, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-N-[2-(2-methoxyethoxy)ethyl]-1-phenyl-2-piperidin-1-ylethanamine is sourced from PubChem (CID 10380812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).