1-(2-pyrrolidin-1-ylethoxymethyl)cyclopentan-1-amine

C12H24N2O — CID 64571822

IUPAC1-(2-pyrrolidin-1-ylethoxymethyl)cyclopentan-1-amine
SMILESNC1(COCCN2CCCC2)CCCC1
InChIInChI=1S/C12H24N2O/c13-12(5-1-2-6-12)11-15-10-9-14-7-3-4-8-14/h1-11,13H2
InChIKeyUMJVSPOGSVJCDJ-UHFFFAOYSA-N
MW212.34 g/mol
LogP1.37
Rot. Bonds5

About 1-(2-pyrrolidin-1-ylethoxymethyl)cyclopentan-1-amine

1-(2-pyrrolidin-1-ylethoxymethyl)cyclopentan-1-amine (PubChem CID 64571822) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is 1-(2-pyrrolidin-1-ylethoxymethyl)cyclopentan-1-amine.

Molecular Properties

Compound Name1-(2-pyrrolidin-1-ylethoxymethyl)cyclopentan-1-amine
PubChem CID64571822
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name1-(2-pyrrolidin-1-ylethoxymethyl)cyclopentan-1-amine
SMILESNC1(COCCN2CCCC2)CCCC1
InChIInChI=1S/C12H24N2O/c13-12(5-1-2-6-12)11-15-10-9-14-7-3-4-8-14/h1-11,13H2
InChIKeyUMJVSPOGSVJCDJ-UHFFFAOYSA-N
XLogP1.37
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.37
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-pyrrolidin-1-ylethoxymethyl)cyclopentan-1-amine?
The IUPAC name of 1-(2-pyrrolidin-1-ylethoxymethyl)cyclopentan-1-amine (CID 64571822) is 1-(2-pyrrolidin-1-ylethoxymethyl)cyclopentan-1-amine.
What is the SMILES notation for 1-(2-pyrrolidin-1-ylethoxymethyl)cyclopentan-1-amine?
The canonical SMILES for 1-(2-pyrrolidin-1-ylethoxymethyl)cyclopentan-1-amine is NC1(COCCN2CCCC2)CCCC1.
What is the InChIKey of 1-(2-pyrrolidin-1-ylethoxymethyl)cyclopentan-1-amine?
The InChIKey is UMJVSPOGSVJCDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c13-12(5-1-2-6-12)11-15-10-9-14-7-3-4-8-14/h1-11,13H2.
What are the key properties of 1-(2-pyrrolidin-1-ylethoxymethyl)cyclopentan-1-amine?
1-(2-pyrrolidin-1-ylethoxymethyl)cyclopentan-1-amine has a molecular weight of 212.34 g/mol, XLogP of 1.37, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-pyrrolidin-1-ylethoxymethyl)cyclopentan-1-amine is sourced from PubChem (CID 64571822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).