N-cyclopentyloxy-2-cyclopropylethanamine

C10H19NO — CID 83228296

IUPACN-cyclopentyloxy-2-cyclopropylethanamine
SMILESC1CCC(ONCCC2CC2)C1
InChIInChI=1S/C10H19NO/c1-2-4-10(3-1)12-11-8-7-9-5-6-9/h9-11H,1-8H2
InChIKeyJJIJFQMSISWKCR-UHFFFAOYSA-N
MW169.27 g/mol
LogP2.25
Rot. Bonds5

About N-cyclopentyloxy-2-cyclopropylethanamine

N-cyclopentyloxy-2-cyclopropylethanamine (PubChem CID 83228296) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is N-cyclopentyloxy-2-cyclopropylethanamine.

Molecular Properties

Compound NameN-cyclopentyloxy-2-cyclopropylethanamine
PubChem CID83228296
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC NameN-cyclopentyloxy-2-cyclopropylethanamine
SMILESC1CCC(ONCCC2CC2)C1
InChIInChI=1S/C10H19NO/c1-2-4-10(3-1)12-11-8-7-9-5-6-9/h9-11H,1-8H2
InChIKeyJJIJFQMSISWKCR-UHFFFAOYSA-N
XLogP2.25
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyloxy-2-cyclopropylethanamine?
The IUPAC name of N-cyclopentyloxy-2-cyclopropylethanamine (CID 83228296) is N-cyclopentyloxy-2-cyclopropylethanamine.
What is the SMILES notation for N-cyclopentyloxy-2-cyclopropylethanamine?
The canonical SMILES for N-cyclopentyloxy-2-cyclopropylethanamine is C1CCC(ONCCC2CC2)C1.
What is the InChIKey of N-cyclopentyloxy-2-cyclopropylethanamine?
The InChIKey is JJIJFQMSISWKCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-2-4-10(3-1)12-11-8-7-9-5-6-9/h9-11H,1-8H2.
What are the key properties of N-cyclopentyloxy-2-cyclopropylethanamine?
N-cyclopentyloxy-2-cyclopropylethanamine has a molecular weight of 169.27 g/mol, XLogP of 2.25, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyloxy-2-cyclopropylethanamine is sourced from PubChem (CID 83228296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).