2-propan-2-yl-1-propan-2-ylimino-2-azaspiro[4.5]deca-6,9-diene-3,8-dione

C15H20N2O2 — CID 12582288

IUPAC2-propan-2-yl-1-propan-2-ylimino-2-azaspiro[4.5]deca-6,9-diene-3,8-dione
SMILESCC(C)/N=C1\N(C(C)C)C(=O)CC12C=CC(=O)C=C2
InChIInChI=1S/C15H20N2O2/c1-10(2)16-14-15(7-5-12(18)6-8-15)9-13(19)17(14)11(3)4/h5-8,10-11H,9H2,1-4H3/b16-14-
InChIKeyOMJQJSWCEJYIKX-PEZBUJJGSA-N
MW260.34 g/mol
LogP2.12
Rot. Bonds2

About 2-propan-2-yl-1-propan-2-ylimino-2-azaspiro[4.5]deca-6,9-diene-3,8-dione

2-propan-2-yl-1-propan-2-ylimino-2-azaspiro[4.5]deca-6,9-diene-3,8-dione (PubChem CID 12582288) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is 2-propan-2-yl-1-propan-2-ylimino-2-azaspiro[4.5]deca-6,9-diene-3,8-dione.

Molecular Properties

Compound Name2-propan-2-yl-1-propan-2-ylimino-2-azaspiro[4.5]deca-6,9-diene-3,8-dione
PubChem CID12582288
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC Name2-propan-2-yl-1-propan-2-ylimino-2-azaspiro[4.5]deca-6,9-diene-3,8-dione
SMILESCC(C)/N=C1\N(C(C)C)C(=O)CC12C=CC(=O)C=C2
InChIInChI=1S/C15H20N2O2/c1-10(2)16-14-15(7-5-12(18)6-8-15)9-13(19)17(14)11(3)4/h5-8,10-11H,9H2,1-4H3/b16-14-
InChIKeyOMJQJSWCEJYIKX-PEZBUJJGSA-N
XLogP2.12
TPSA49.74 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 52.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

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CID 65243320
3,4,4-trimethyl-1-propan-2-yl-6-propan-2-ylimino-1,3,5-triazinan-2-one
CID 161465016
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CID 51703961
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CID 60644562
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CID 141365224
1-methyl-3-propan-2-ylimidazolidine-2,4-dione
CID 18669456
cyclohexa-2,5-diene-1,4-dione;propan-2-amine
CID 175470466
2-N,5-N-di(propan-2-yl)pyrrole-2,5-diimine
CID 154502297

Frequently Asked Questions

What is the IUPAC name of 2-propan-2-yl-1-propan-2-ylimino-2-azaspiro[4.5]deca-6,9-diene-3,8-dione?
The IUPAC name of 2-propan-2-yl-1-propan-2-ylimino-2-azaspiro[4.5]deca-6,9-diene-3,8-dione (CID 12582288) is 2-propan-2-yl-1-propan-2-ylimino-2-azaspiro[4.5]deca-6,9-diene-3,8-dione.
What is the SMILES notation for 2-propan-2-yl-1-propan-2-ylimino-2-azaspiro[4.5]deca-6,9-diene-3,8-dione?
The canonical SMILES for 2-propan-2-yl-1-propan-2-ylimino-2-azaspiro[4.5]deca-6,9-diene-3,8-dione is CC(C)/N=C1\N(C(C)C)C(=O)CC12C=CC(=O)C=C2.
What is the InChIKey of 2-propan-2-yl-1-propan-2-ylimino-2-azaspiro[4.5]deca-6,9-diene-3,8-dione?
The InChIKey is OMJQJSWCEJYIKX-PEZBUJJGSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-10(2)16-14-15(7-5-12(18)6-8-15)9-13(19)17(14)11(3)4/h5-8,10-11H,9H2,1-4H3/b16-14-.
What are the key properties of 2-propan-2-yl-1-propan-2-ylimino-2-azaspiro[4.5]deca-6,9-diene-3,8-dione?
2-propan-2-yl-1-propan-2-ylimino-2-azaspiro[4.5]deca-6,9-diene-3,8-dione has a molecular weight of 260.34 g/mol, XLogP of 2.12, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propan-2-yl-1-propan-2-ylimino-2-azaspiro[4.5]deca-6,9-diene-3,8-dione is sourced from PubChem (CID 12582288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).