9-prop-1-en-2-yl-1,3,9-triazaspiro[4.5]decane-2,4-dione

C10H15N3O2 — CID 70214165

IUPAC9-prop-1-en-2-yl-1,3,9-triazaspiro[4.5]decane-2,4-dione
SMILESC=C(C)N1CCCC2(C1)NC(=O)NC2=O
InChIInChI=1S/C10H15N3O2/c1-7(2)13-5-3-4-10(6-13)8(14)11-9(15)12-10/h1,3-6H2,2H3,(H2,11,12,14,15)
InChIKeyYNBGETYUKYMQSS-UHFFFAOYSA-N
MW209.25 g/mol
LogP0.19
Rot. Bonds1

About 9-prop-1-en-2-yl-1,3,9-triazaspiro[4.5]decane-2,4-dione

9-prop-1-en-2-yl-1,3,9-triazaspiro[4.5]decane-2,4-dione (PubChem CID 70214165) has the molecular formula C10H15N3O2 and a molecular weight of 209.25 g/mol. Its IUPAC name is 9-prop-1-en-2-yl-1,3,9-triazaspiro[4.5]decane-2,4-dione.

Molecular Properties

Compound Name9-prop-1-en-2-yl-1,3,9-triazaspiro[4.5]decane-2,4-dione
PubChem CID70214165
Molecular FormulaC10H15N3O2
Molecular Weight209.25 g/mol
Exact Mass209.12
IUPAC Name9-prop-1-en-2-yl-1,3,9-triazaspiro[4.5]decane-2,4-dione
SMILESC=C(C)N1CCCC2(C1)NC(=O)NC2=O
InChIInChI=1S/C10H15N3O2/c1-7(2)13-5-3-4-10(6-13)8(14)11-9(15)12-10/h1,3-6H2,2H3,(H2,11,12,14,15)
InChIKeyYNBGETYUKYMQSS-UHFFFAOYSA-N
XLogP0.19
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 50.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 9-prop-1-en-2-yl-1,3,9-triazaspiro[4.5]decane-2,4-dione?
The IUPAC name of 9-prop-1-en-2-yl-1,3,9-triazaspiro[4.5]decane-2,4-dione (CID 70214165) is 9-prop-1-en-2-yl-1,3,9-triazaspiro[4.5]decane-2,4-dione.
What is the SMILES notation for 9-prop-1-en-2-yl-1,3,9-triazaspiro[4.5]decane-2,4-dione?
The canonical SMILES for 9-prop-1-en-2-yl-1,3,9-triazaspiro[4.5]decane-2,4-dione is C=C(C)N1CCCC2(C1)NC(=O)NC2=O.
What is the InChIKey of 9-prop-1-en-2-yl-1,3,9-triazaspiro[4.5]decane-2,4-dione?
The InChIKey is YNBGETYUKYMQSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2/c1-7(2)13-5-3-4-10(6-13)8(14)11-9(15)12-10/h1,3-6H2,2H3,(H2,11,12,14,15).
What are the key properties of 9-prop-1-en-2-yl-1,3,9-triazaspiro[4.5]decane-2,4-dione?
9-prop-1-en-2-yl-1,3,9-triazaspiro[4.5]decane-2,4-dione has a molecular weight of 209.25 g/mol, XLogP of 0.19, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-prop-1-en-2-yl-1,3,9-triazaspiro[4.5]decane-2,4-dione is sourced from PubChem (CID 70214165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).