hydrazinyl 3-(2-ethylpiperidin-1-yl)propanoate

C10H21N3O2 — CID 66337668

IUPAChydrazinyl 3-(2-ethylpiperidin-1-yl)propanoate
SMILESCCC1CCCCN1CCC(=O)ONN
InChIInChI=1S/C10H21N3O2/c1-2-9-5-3-4-7-13(9)8-6-10(14)15-12-11/h9,12H,2-8,11H2,1H3
InChIKeyPIQIORZYLSJWAC-UHFFFAOYSA-N
MW215.30 g/mol
LogP0.56
Rot. Bonds5

About hydrazinyl 3-(2-ethylpiperidin-1-yl)propanoate

hydrazinyl 3-(2-ethylpiperidin-1-yl)propanoate (PubChem CID 66337668) has the molecular formula C10H21N3O2 and a molecular weight of 215.30 g/mol. Its IUPAC name is hydrazinyl 3-(2-ethylpiperidin-1-yl)propanoate.

Molecular Properties

Compound Namehydrazinyl 3-(2-ethylpiperidin-1-yl)propanoate
PubChem CID66337668
Molecular FormulaC10H21N3O2
Molecular Weight215.30 g/mol
Exact Mass215.16
IUPAC Namehydrazinyl 3-(2-ethylpiperidin-1-yl)propanoate
SMILESCCC1CCCCN1CCC(=O)ONN
InChIInChI=1S/C10H21N3O2/c1-2-9-5-3-4-7-13(9)8-6-10(14)15-12-11/h9,12H,2-8,11H2,1H3
InChIKeyPIQIORZYLSJWAC-UHFFFAOYSA-N
XLogP0.56
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 ≤ 50.56
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-(2-ethylpiperidin-1-yl)propanoate?
The IUPAC name of hydrazinyl 3-(2-ethylpiperidin-1-yl)propanoate (CID 66337668) is hydrazinyl 3-(2-ethylpiperidin-1-yl)propanoate.
What is the SMILES notation for hydrazinyl 3-(2-ethylpiperidin-1-yl)propanoate?
The canonical SMILES for hydrazinyl 3-(2-ethylpiperidin-1-yl)propanoate is CCC1CCCCN1CCC(=O)ONN.
What is the InChIKey of hydrazinyl 3-(2-ethylpiperidin-1-yl)propanoate?
The InChIKey is PIQIORZYLSJWAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O2/c1-2-9-5-3-4-7-13(9)8-6-10(14)15-12-11/h9,12H,2-8,11H2,1H3.
What are the key properties of hydrazinyl 3-(2-ethylpiperidin-1-yl)propanoate?
hydrazinyl 3-(2-ethylpiperidin-1-yl)propanoate has a molecular weight of 215.30 g/mol, XLogP of 0.56, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for hydrazinyl 3-(2-ethylpiperidin-1-yl)propanoate is sourced from PubChem (CID 66337668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).