1-[2-(2-methoxyethoxy)ethoxymethyl]cyclopentan-1-amine

C11H23NO3 — CID 64573529

IUPAC1-[2-(2-methoxyethoxy)ethoxymethyl]cyclopentan-1-amine
SMILESCOCCOCCOCC1(N)CCCC1
InChIInChI=1S/C11H23NO3/c1-13-6-7-14-8-9-15-10-11(12)4-2-3-5-11/h2-10,12H2,1H3
InChIKeyJZNIAYFYCMSKLO-UHFFFAOYSA-N
MW217.31 g/mol
LogP0.94
Rot. Bonds8

About 1-[2-(2-methoxyethoxy)ethoxymethyl]cyclopentan-1-amine

1-[2-(2-methoxyethoxy)ethoxymethyl]cyclopentan-1-amine (PubChem CID 64573529) has the molecular formula C11H23NO3 and a molecular weight of 217.31 g/mol. Its IUPAC name is 1-[2-(2-methoxyethoxy)ethoxymethyl]cyclopentan-1-amine.

Molecular Properties

Compound Name1-[2-(2-methoxyethoxy)ethoxymethyl]cyclopentan-1-amine
PubChem CID64573529
Molecular FormulaC11H23NO3
Molecular Weight217.31 g/mol
Exact Mass217.17
IUPAC Name1-[2-(2-methoxyethoxy)ethoxymethyl]cyclopentan-1-amine
SMILESCOCCOCCOCC1(N)CCCC1
InChIInChI=1S/C11H23NO3/c1-13-6-7-14-8-9-15-10-11(12)4-2-3-5-11/h2-10,12H2,1H3
InChIKeyJZNIAYFYCMSKLO-UHFFFAOYSA-N
XLogP0.94
TPSA53.71 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 ≤ 50.94
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 1-[2-(2-methoxyethoxy)ethoxymethyl]cyclopentan-1-amine?
The IUPAC name of 1-[2-(2-methoxyethoxy)ethoxymethyl]cyclopentan-1-amine (CID 64573529) is 1-[2-(2-methoxyethoxy)ethoxymethyl]cyclopentan-1-amine.
What is the SMILES notation for 1-[2-(2-methoxyethoxy)ethoxymethyl]cyclopentan-1-amine?
The canonical SMILES for 1-[2-(2-methoxyethoxy)ethoxymethyl]cyclopentan-1-amine is COCCOCCOCC1(N)CCCC1.
What is the InChIKey of 1-[2-(2-methoxyethoxy)ethoxymethyl]cyclopentan-1-amine?
The InChIKey is JZNIAYFYCMSKLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO3/c1-13-6-7-14-8-9-15-10-11(12)4-2-3-5-11/h2-10,12H2,1H3.
What are the key properties of 1-[2-(2-methoxyethoxy)ethoxymethyl]cyclopentan-1-amine?
1-[2-(2-methoxyethoxy)ethoxymethyl]cyclopentan-1-amine has a molecular weight of 217.31 g/mol, XLogP of 0.94, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-methoxyethoxy)ethoxymethyl]cyclopentan-1-amine is sourced from PubChem (CID 64573529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).