hydrazinyl 3-[ethyl(oxolan-2-ylmethyl)amino]propanoate

C10H21N3O3 — CID 66337856

IUPAChydrazinyl 3-[ethyl(oxolan-2-ylmethyl)amino]propanoate
SMILESCCN(CCC(=O)ONN)CC1CCCO1
InChIInChI=1S/C10H21N3O3/c1-2-13(6-5-10(14)16-12-11)8-9-4-3-7-15-9/h9,12H,2-8,11H2,1H3
InChIKeyLYGQQTAUQUZYTH-UHFFFAOYSA-N
MW231.30 g/mol
LogP-0.20
Rot. Bonds7

About hydrazinyl 3-[ethyl(oxolan-2-ylmethyl)amino]propanoate

hydrazinyl 3-[ethyl(oxolan-2-ylmethyl)amino]propanoate (PubChem CID 66337856) has the molecular formula C10H21N3O3 and a molecular weight of 231.30 g/mol. Its IUPAC name is hydrazinyl 3-[ethyl(oxolan-2-ylmethyl)amino]propanoate.

Molecular Properties

Compound Namehydrazinyl 3-[ethyl(oxolan-2-ylmethyl)amino]propanoate
PubChem CID66337856
Molecular FormulaC10H21N3O3
Molecular Weight231.30 g/mol
Exact Mass231.16
IUPAC Namehydrazinyl 3-[ethyl(oxolan-2-ylmethyl)amino]propanoate
SMILESCCN(CCC(=O)ONN)CC1CCCO1
InChIInChI=1S/C10H21N3O3/c1-2-13(6-5-10(14)16-12-11)8-9-4-3-7-15-9/h9,12H,2-8,11H2,1H3
InChIKeyLYGQQTAUQUZYTH-UHFFFAOYSA-N
XLogP-0.20
TPSA76.82 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.30
LogP ≤ 5-0.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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-[ethyl(oxolan-2-ylmethyl)amino]propanoate?
The IUPAC name of hydrazinyl 3-[ethyl(oxolan-2-ylmethyl)amino]propanoate (CID 66337856) is hydrazinyl 3-[ethyl(oxolan-2-ylmethyl)amino]propanoate.
What is the SMILES notation for hydrazinyl 3-[ethyl(oxolan-2-ylmethyl)amino]propanoate?
The canonical SMILES for hydrazinyl 3-[ethyl(oxolan-2-ylmethyl)amino]propanoate is CCN(CCC(=O)ONN)CC1CCCO1.
What is the InChIKey of hydrazinyl 3-[ethyl(oxolan-2-ylmethyl)amino]propanoate?
The InChIKey is LYGQQTAUQUZYTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O3/c1-2-13(6-5-10(14)16-12-11)8-9-4-3-7-15-9/h9,12H,2-8,11H2,1H3.
What are the key properties of hydrazinyl 3-[ethyl(oxolan-2-ylmethyl)amino]propanoate?
hydrazinyl 3-[ethyl(oxolan-2-ylmethyl)amino]propanoate has a molecular weight of 231.30 g/mol, XLogP of -0.20, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for hydrazinyl 3-[ethyl(oxolan-2-ylmethyl)amino]propanoate is sourced from PubChem (CID 66337856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).