N-[2-(2-ethoxyethoxy)ethyl]oxan-4-amine

C11H23NO3 — CID 63099695

IUPACN-[2-(2-ethoxyethoxy)ethyl]oxan-4-amine
SMILESCCOCCOCCNC1CCOCC1
InChIInChI=1S/C11H23NO3/c1-2-13-9-10-15-8-5-12-11-3-6-14-7-4-11/h11-12H,2-10H2,1H3
InChIKeyUQJVUQLNRSBMKV-UHFFFAOYSA-N
MW217.31 g/mol
LogP0.81
Rot. Bonds8

About N-[2-(2-ethoxyethoxy)ethyl]oxan-4-amine

N-[2-(2-ethoxyethoxy)ethyl]oxan-4-amine (PubChem CID 63099695) has the molecular formula C11H23NO3 and a molecular weight of 217.31 g/mol. Its IUPAC name is N-[2-(2-ethoxyethoxy)ethyl]oxan-4-amine.

Molecular Properties

Compound NameN-[2-(2-ethoxyethoxy)ethyl]oxan-4-amine
PubChem CID63099695
Molecular FormulaC11H23NO3
Molecular Weight217.31 g/mol
Exact Mass217.17
IUPAC NameN-[2-(2-ethoxyethoxy)ethyl]oxan-4-amine
SMILESCCOCCOCCNC1CCOCC1
InChIInChI=1S/C11H23NO3/c1-2-13-9-10-15-8-5-12-11-3-6-14-7-4-11/h11-12H,2-10H2,1H3
InChIKeyUQJVUQLNRSBMKV-UHFFFAOYSA-N
XLogP0.81
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 50.81
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 N-[2-(2-ethoxyethoxy)ethyl]oxan-4-amine?
The IUPAC name of N-[2-(2-ethoxyethoxy)ethyl]oxan-4-amine (CID 63099695) is N-[2-(2-ethoxyethoxy)ethyl]oxan-4-amine.
What is the SMILES notation for N-[2-(2-ethoxyethoxy)ethyl]oxan-4-amine?
The canonical SMILES for N-[2-(2-ethoxyethoxy)ethyl]oxan-4-amine is CCOCCOCCNC1CCOCC1.
What is the InChIKey of N-[2-(2-ethoxyethoxy)ethyl]oxan-4-amine?
The InChIKey is UQJVUQLNRSBMKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO3/c1-2-13-9-10-15-8-5-12-11-3-6-14-7-4-11/h11-12H,2-10H2,1H3.
What are the key properties of N-[2-(2-ethoxyethoxy)ethyl]oxan-4-amine?
N-[2-(2-ethoxyethoxy)ethyl]oxan-4-amine has a molecular weight of 217.31 g/mol, XLogP of 0.81, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-ethoxyethoxy)ethyl]oxan-4-amine is sourced from PubChem (CID 63099695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).