hydrazinyl 3-(3-ethylpiperidin-1-yl)propanoate

C10H21N3O2 — CID 66339133

IUPAChydrazinyl 3-(3-ethylpiperidin-1-yl)propanoate
SMILESCCC1CCCN(CCC(=O)ONN)C1
InChIInChI=1S/C10H21N3O2/c1-2-9-4-3-6-13(8-9)7-5-10(14)15-12-11/h9,12H,2-8,11H2,1H3
InChIKeyJEANKRDANIHBGA-UHFFFAOYSA-N
MW215.30 g/mol
LogP0.42
Rot. Bonds5

About hydrazinyl 3-(3-ethylpiperidin-1-yl)propanoate

hydrazinyl 3-(3-ethylpiperidin-1-yl)propanoate (PubChem CID 66339133) has the molecular formula C10H21N3O2 and a molecular weight of 215.30 g/mol. Its IUPAC name is hydrazinyl 3-(3-ethylpiperidin-1-yl)propanoate.

Molecular Properties

Compound Namehydrazinyl 3-(3-ethylpiperidin-1-yl)propanoate
PubChem CID66339133
Molecular FormulaC10H21N3O2
Molecular Weight215.30 g/mol
Exact Mass215.16
IUPAC Namehydrazinyl 3-(3-ethylpiperidin-1-yl)propanoate
SMILESCCC1CCCN(CCC(=O)ONN)C1
InChIInChI=1S/C10H21N3O2/c1-2-9-4-3-6-13(8-9)7-5-10(14)15-12-11/h9,12H,2-8,11H2,1H3
InChIKeyJEANKRDANIHBGA-UHFFFAOYSA-N
XLogP0.42
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 50.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', '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 hydrazinyl 3-(3-ethylpiperidin-1-yl)propanoate?
The IUPAC name of hydrazinyl 3-(3-ethylpiperidin-1-yl)propanoate (CID 66339133) is hydrazinyl 3-(3-ethylpiperidin-1-yl)propanoate.
What is the SMILES notation for hydrazinyl 3-(3-ethylpiperidin-1-yl)propanoate?
The canonical SMILES for hydrazinyl 3-(3-ethylpiperidin-1-yl)propanoate is CCC1CCCN(CCC(=O)ONN)C1.
What is the InChIKey of hydrazinyl 3-(3-ethylpiperidin-1-yl)propanoate?
The InChIKey is JEANKRDANIHBGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O2/c1-2-9-4-3-6-13(8-9)7-5-10(14)15-12-11/h9,12H,2-8,11H2,1H3.
What are the key properties of hydrazinyl 3-(3-ethylpiperidin-1-yl)propanoate?
hydrazinyl 3-(3-ethylpiperidin-1-yl)propanoate has a molecular weight of 215.30 g/mol, XLogP of 0.42, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for hydrazinyl 3-(3-ethylpiperidin-1-yl)propanoate is sourced from PubChem (CID 66339133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).