1-(2-propoxyethoxymethyl)cyclopentan-1-amine

C11H23NO2 — CID 106454305

IUPAC1-(2-propoxyethoxymethyl)cyclopentan-1-amine
SMILESCCCOCCOCC1(N)CCCC1
InChIInChI=1S/C11H23NO2/c1-2-7-13-8-9-14-10-11(12)5-3-4-6-11/h2-10,12H2,1H3
InChIKeyHNMYNKGUVQFVSH-UHFFFAOYSA-N
MW201.31 g/mol
LogP1.70
Rot. Bonds7

About 1-(2-propoxyethoxymethyl)cyclopentan-1-amine

1-(2-propoxyethoxymethyl)cyclopentan-1-amine (PubChem CID 106454305) has the molecular formula C11H23NO2 and a molecular weight of 201.31 g/mol. Its IUPAC name is 1-(2-propoxyethoxymethyl)cyclopentan-1-amine.

Molecular Properties

Compound Name1-(2-propoxyethoxymethyl)cyclopentan-1-amine
PubChem CID106454305
Molecular FormulaC11H23NO2
Molecular Weight201.31 g/mol
Exact Mass201.17
IUPAC Name1-(2-propoxyethoxymethyl)cyclopentan-1-amine
SMILESCCCOCCOCC1(N)CCCC1
InChIInChI=1S/C11H23NO2/c1-2-7-13-8-9-14-10-11(12)5-3-4-6-11/h2-10,12H2,1H3
InChIKeyHNMYNKGUVQFVSH-UHFFFAOYSA-N
XLogP1.70
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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-propoxyethoxymethyl)cyclopentan-1-amine?
The IUPAC name of 1-(2-propoxyethoxymethyl)cyclopentan-1-amine (CID 106454305) is 1-(2-propoxyethoxymethyl)cyclopentan-1-amine.
What is the SMILES notation for 1-(2-propoxyethoxymethyl)cyclopentan-1-amine?
The canonical SMILES for 1-(2-propoxyethoxymethyl)cyclopentan-1-amine is CCCOCCOCC1(N)CCCC1.
What is the InChIKey of 1-(2-propoxyethoxymethyl)cyclopentan-1-amine?
The InChIKey is HNMYNKGUVQFVSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2/c1-2-7-13-8-9-14-10-11(12)5-3-4-6-11/h2-10,12H2,1H3.
What are the key properties of 1-(2-propoxyethoxymethyl)cyclopentan-1-amine?
1-(2-propoxyethoxymethyl)cyclopentan-1-amine has a molecular weight of 201.31 g/mol, XLogP of 1.70, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-propoxyethoxymethyl)cyclopentan-1-amine is sourced from PubChem (CID 106454305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).