hydrazinyl 3-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)propanoate

C10H16N4O4 — CID 66337140

IUPAChydrazinyl 3-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)propanoate
SMILESNNOC(=O)CCN1C(=O)NC2(CCCC2)C1=O
InChIInChI=1S/C10H16N4O4/c11-13-18-7(15)3-6-14-8(16)10(12-9(14)17)4-1-2-5-10/h13H,1-6,11H2,(H,12,17)
InChIKeyGNSDRKUXMKMJLP-UHFFFAOYSA-N
MW256.26 g/mol
LogP-0.84
Rot. Bonds4

About hydrazinyl 3-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)propanoate

hydrazinyl 3-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)propanoate (PubChem CID 66337140) has the molecular formula C10H16N4O4 and a molecular weight of 256.26 g/mol. Its IUPAC name is hydrazinyl 3-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)propanoate.

Molecular Properties

Compound Namehydrazinyl 3-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)propanoate
PubChem CID66337140
Molecular FormulaC10H16N4O4
Molecular Weight256.26 g/mol
Exact Mass256.12
IUPAC Namehydrazinyl 3-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)propanoate
SMILESNNOC(=O)CCN1C(=O)NC2(CCCC2)C1=O
InChIInChI=1S/C10H16N4O4/c11-13-18-7(15)3-6-14-8(16)10(12-9(14)17)4-1-2-5-10/h13H,1-6,11H2,(H,12,17)
InChIKeyGNSDRKUXMKMJLP-UHFFFAOYSA-N
XLogP-0.84
TPSA113.76 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.26
LogP ≤ 5-0.84
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}, {'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-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)propanoate?
The IUPAC name of hydrazinyl 3-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)propanoate (CID 66337140) is hydrazinyl 3-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)propanoate.
What is the SMILES notation for hydrazinyl 3-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)propanoate?
The canonical SMILES for hydrazinyl 3-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)propanoate is NNOC(=O)CCN1C(=O)NC2(CCCC2)C1=O.
What is the InChIKey of hydrazinyl 3-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)propanoate?
The InChIKey is GNSDRKUXMKMJLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O4/c11-13-18-7(15)3-6-14-8(16)10(12-9(14)17)4-1-2-5-10/h13H,1-6,11H2,(H,12,17).
What are the key properties of hydrazinyl 3-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)propanoate?
hydrazinyl 3-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)propanoate has a molecular weight of 256.26 g/mol, XLogP of -0.84, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for hydrazinyl 3-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)propanoate is sourced from PubChem (CID 66337140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).