2-amino-N-[2-(cyclopenten-1-yl)ethyl]-3-methoxypropanamide

C11H20N2O2 — CID 106175111

IUPAC2-amino-N-[2-(cyclopenten-1-yl)ethyl]-3-methoxypropanamide
SMILESCOCC(N)C(=O)NCCC1=CCCC1
InChIInChI=1S/C11H20N2O2/c1-15-8-10(12)11(14)13-7-6-9-4-2-3-5-9/h4,10H,2-3,5-8,12H2,1H3,(H,13,14)
InChIKeyZUSPECZQACWVPS-UHFFFAOYSA-N
MW212.29 g/mol
LogP0.58
Rot. Bonds6

About 2-amino-N-[2-(cyclopenten-1-yl)ethyl]-3-methoxypropanamide

2-amino-N-[2-(cyclopenten-1-yl)ethyl]-3-methoxypropanamide (PubChem CID 106175111) has the molecular formula C11H20N2O2 and a molecular weight of 212.29 g/mol. Its IUPAC name is 2-amino-N-[2-(cyclopenten-1-yl)ethyl]-3-methoxypropanamide.

Molecular Properties

Compound Name2-amino-N-[2-(cyclopenten-1-yl)ethyl]-3-methoxypropanamide
PubChem CID106175111
Molecular FormulaC11H20N2O2
Molecular Weight212.29 g/mol
Exact Mass212.15
IUPAC Name2-amino-N-[2-(cyclopenten-1-yl)ethyl]-3-methoxypropanamide
SMILESCOCC(N)C(=O)NCCC1=CCCC1
InChIInChI=1S/C11H20N2O2/c1-15-8-10(12)11(14)13-7-6-9-4-2-3-5-9/h4,10H,2-3,5-8,12H2,1H3,(H,13,14)
InChIKeyZUSPECZQACWVPS-UHFFFAOYSA-N
XLogP0.58
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 50.58
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-amino-N-[2-(cyclopenten-1-yl)ethyl]-3-methoxypropanamide?
The IUPAC name of 2-amino-N-[2-(cyclopenten-1-yl)ethyl]-3-methoxypropanamide (CID 106175111) is 2-amino-N-[2-(cyclopenten-1-yl)ethyl]-3-methoxypropanamide.
What is the SMILES notation for 2-amino-N-[2-(cyclopenten-1-yl)ethyl]-3-methoxypropanamide?
The canonical SMILES for 2-amino-N-[2-(cyclopenten-1-yl)ethyl]-3-methoxypropanamide is COCC(N)C(=O)NCCC1=CCCC1.
What is the InChIKey of 2-amino-N-[2-(cyclopenten-1-yl)ethyl]-3-methoxypropanamide?
The InChIKey is ZUSPECZQACWVPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O2/c1-15-8-10(12)11(14)13-7-6-9-4-2-3-5-9/h4,10H,2-3,5-8,12H2,1H3,(H,13,14).
What are the key properties of 2-amino-N-[2-(cyclopenten-1-yl)ethyl]-3-methoxypropanamide?
2-amino-N-[2-(cyclopenten-1-yl)ethyl]-3-methoxypropanamide has a molecular weight of 212.29 g/mol, XLogP of 0.58, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-(cyclopenten-1-yl)ethyl]-3-methoxypropanamide is sourced from PubChem (CID 106175111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).