2-(3-aminocyclopentyl)oxy-N-prop-2-enylpropanamide

C11H20N2O2 — CID 79464530

IUPAC2-(3-aminocyclopentyl)oxy-N-prop-2-enylpropanamide
SMILESC=CCNC(=O)C(C)OC1CCC(N)C1
InChIInChI=1S/C11H20N2O2/c1-3-6-13-11(14)8(2)15-10-5-4-9(12)7-10/h3,8-10H,1,4-7,12H2,2H3,(H,13,14)
InChIKeyRCQIAASFFKKODJ-UHFFFAOYSA-N
MW212.29 g/mol
LogP0.57
Rot. Bonds5

About 2-(3-aminocyclopentyl)oxy-N-prop-2-enylpropanamide

2-(3-aminocyclopentyl)oxy-N-prop-2-enylpropanamide (PubChem CID 79464530) has the molecular formula C11H20N2O2 and a molecular weight of 212.29 g/mol. Its IUPAC name is 2-(3-aminocyclopentyl)oxy-N-prop-2-enylpropanamide.

Molecular Properties

Compound Name2-(3-aminocyclopentyl)oxy-N-prop-2-enylpropanamide
PubChem CID79464530
Molecular FormulaC11H20N2O2
Molecular Weight212.29 g/mol
Exact Mass212.15
IUPAC Name2-(3-aminocyclopentyl)oxy-N-prop-2-enylpropanamide
SMILESC=CCNC(=O)C(C)OC1CCC(N)C1
InChIInChI=1S/C11H20N2O2/c1-3-6-13-11(14)8(2)15-10-5-4-9(12)7-10/h3,8-10H,1,4-7,12H2,2H3,(H,13,14)
InChIKeyRCQIAASFFKKODJ-UHFFFAOYSA-N
XLogP0.57
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 50.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(3-aminocyclopentyl)oxy-N-prop-2-enylpropanamide?
The IUPAC name of 2-(3-aminocyclopentyl)oxy-N-prop-2-enylpropanamide (CID 79464530) is 2-(3-aminocyclopentyl)oxy-N-prop-2-enylpropanamide.
What is the SMILES notation for 2-(3-aminocyclopentyl)oxy-N-prop-2-enylpropanamide?
The canonical SMILES for 2-(3-aminocyclopentyl)oxy-N-prop-2-enylpropanamide is C=CCNC(=O)C(C)OC1CCC(N)C1.
What is the InChIKey of 2-(3-aminocyclopentyl)oxy-N-prop-2-enylpropanamide?
The InChIKey is RCQIAASFFKKODJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O2/c1-3-6-13-11(14)8(2)15-10-5-4-9(12)7-10/h3,8-10H,1,4-7,12H2,2H3,(H,13,14).
What are the key properties of 2-(3-aminocyclopentyl)oxy-N-prop-2-enylpropanamide?
2-(3-aminocyclopentyl)oxy-N-prop-2-enylpropanamide has a molecular weight of 212.29 g/mol, XLogP of 0.57, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-aminocyclopentyl)oxy-N-prop-2-enylpropanamide is sourced from PubChem (CID 79464530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).