hydrazinyl 3-(2,4-dioxo-8-oxa-1,3-diazaspiro[4.5]decan-3-yl)propanoate

C10H16N4O5 — CID 106528282

IUPAChydrazinyl 3-(2,4-dioxo-8-oxa-1,3-diazaspiro[4.5]decan-3-yl)propanoate
SMILESNNOC(=O)CCN1C(=O)NC2(CCOCC2)C1=O
InChIInChI=1S/C10H16N4O5/c11-13-19-7(15)1-4-14-8(16)10(12-9(14)17)2-5-18-6-3-10/h13H,1-6,11H2,(H,12,17)
InChIKeyOFSCFPANONVNBY-UHFFFAOYSA-N
MW272.26 g/mol
LogP-1.60
Rot. Bonds4

About hydrazinyl 3-(2,4-dioxo-8-oxa-1,3-diazaspiro[4.5]decan-3-yl)propanoate

hydrazinyl 3-(2,4-dioxo-8-oxa-1,3-diazaspiro[4.5]decan-3-yl)propanoate (PubChem CID 106528282) has the molecular formula C10H16N4O5 and a molecular weight of 272.26 g/mol. Its IUPAC name is hydrazinyl 3-(2,4-dioxo-8-oxa-1,3-diazaspiro[4.5]decan-3-yl)propanoate.

Molecular Properties

Compound Namehydrazinyl 3-(2,4-dioxo-8-oxa-1,3-diazaspiro[4.5]decan-3-yl)propanoate
PubChem CID106528282
Molecular FormulaC10H16N4O5
Molecular Weight272.26 g/mol
Exact Mass272.11
IUPAC Namehydrazinyl 3-(2,4-dioxo-8-oxa-1,3-diazaspiro[4.5]decan-3-yl)propanoate
SMILESNNOC(=O)CCN1C(=O)NC2(CCOCC2)C1=O
InChIInChI=1S/C10H16N4O5/c11-13-19-7(15)1-4-14-8(16)10(12-9(14)17)2-5-18-6-3-10/h13H,1-6,11H2,(H,12,17)
InChIKeyOFSCFPANONVNBY-UHFFFAOYSA-N
XLogP-1.60
TPSA122.99 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.26
LogP ≤ 5-1.60
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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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Related Compounds

hydrazinyl 3-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)propanoate
CID 66337140
4-(2,4-dioxo-8-oxa-1,3-diazaspiro[4.5]decan-3-yl)butanehydrazide
CID 106528283
5-(2,4-dioxo-8-oxa-1,3-diazaspiro[4.5]decan-3-yl)pentanehydrazide
CID 106528280
3-(3,3-dimethylbutyl)-8-oxa-1,3-diazaspiro[4.5]decane-2,4-dione
CID 86804220
3-butyl-8-oxa-1,3-diazaspiro[4.5]decane-2,4-dione
CID 78924546
3-(3-sulfanylpropyl)-8-oxa-1,3-diazaspiro[4.5]decane-2,4-dione
CID 106528289
hydrazinyl 3-(4-butyl-4-methyl-2,5-dioxoimidazolidin-1-yl)propanoate
CID 66337876
3-ethyl-8-oxa-1,3-diazaspiro[4.5]decane-2,4-dione
CID 78924545
2-amino-3-(2,4-dioxo-8-oxa-1,3-diazaspiro[4.5]decan-3-yl)propanoic acid
CID 106528110
3-(2-piperidin-4-ylethyl)-8-oxa-1,3-diazaspiro[4.5]decane-2,4-dione
CID 106528198
3-[2-(aminomethyl)prop-2-enyl]-8-oxa-1,3-diazaspiro[4.5]decane-2,4-dione
CID 106528236
3-(4-amino-3-ethoxybutyl)-8-oxa-1,3-diazaspiro[4.5]decane-2,4-dione
CID 106528076

Frequently Asked Questions

What is the IUPAC name of hydrazinyl 3-(2,4-dioxo-8-oxa-1,3-diazaspiro[4.5]decan-3-yl)propanoate?
The IUPAC name of hydrazinyl 3-(2,4-dioxo-8-oxa-1,3-diazaspiro[4.5]decan-3-yl)propanoate (CID 106528282) is hydrazinyl 3-(2,4-dioxo-8-oxa-1,3-diazaspiro[4.5]decan-3-yl)propanoate.
What is the SMILES notation for hydrazinyl 3-(2,4-dioxo-8-oxa-1,3-diazaspiro[4.5]decan-3-yl)propanoate?
The canonical SMILES for hydrazinyl 3-(2,4-dioxo-8-oxa-1,3-diazaspiro[4.5]decan-3-yl)propanoate is NNOC(=O)CCN1C(=O)NC2(CCOCC2)C1=O.
What is the InChIKey of hydrazinyl 3-(2,4-dioxo-8-oxa-1,3-diazaspiro[4.5]decan-3-yl)propanoate?
The InChIKey is OFSCFPANONVNBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O5/c11-13-19-7(15)1-4-14-8(16)10(12-9(14)17)2-5-18-6-3-10/h13H,1-6,11H2,(H,12,17).
What are the key properties of hydrazinyl 3-(2,4-dioxo-8-oxa-1,3-diazaspiro[4.5]decan-3-yl)propanoate?
hydrazinyl 3-(2,4-dioxo-8-oxa-1,3-diazaspiro[4.5]decan-3-yl)propanoate has a molecular weight of 272.26 g/mol, XLogP of -1.60, 4 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for hydrazinyl 3-(2,4-dioxo-8-oxa-1,3-diazaspiro[4.5]decan-3-yl)propanoate is sourced from PubChem (CID 106528282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).