8,11-dioxa-3-azadispiro[4.1.47.35]tetradecane-2,4-dione

C11H15NO4 — CID 58382565

IUPAC8,11-dioxa-3-azadispiro[4.1.47.35]tetradecane-2,4-dione
SMILESO=C1CC2(CCCC3(C2)OCCO3)C(=O)N1
InChIInChI=1S/C11H15NO4/c13-8-6-10(9(14)12-8)2-1-3-11(7-10)15-4-5-16-11/h1-7H2,(H,12,13,14)
InChIKeyRRTVOMCAWASLFH-UHFFFAOYSA-N
MW225.24 g/mol
LogP0.34
Rot. Bonds

About 8,11-dioxa-3-azadispiro[4.1.47.35]tetradecane-2,4-dione

8,11-dioxa-3-azadispiro[4.1.47.35]tetradecane-2,4-dione (PubChem CID 58382565) has the molecular formula C11H15NO4 and a molecular weight of 225.24 g/mol. Its IUPAC name is 8,11-dioxa-3-azadispiro[4.1.47.35]tetradecane-2,4-dione.

Molecular Properties

Compound Name8,11-dioxa-3-azadispiro[4.1.47.35]tetradecane-2,4-dione
PubChem CID58382565
Molecular FormulaC11H15NO4
Molecular Weight225.24 g/mol
Exact Mass225.10
IUPAC Name8,11-dioxa-3-azadispiro[4.1.47.35]tetradecane-2,4-dione
SMILESO=C1CC2(CCCC3(C2)OCCO3)C(=O)N1
InChIInChI=1S/C11H15NO4/c13-8-6-10(9(14)12-8)2-1-3-11(7-10)15-4-5-16-11/h1-7H2,(H,12,13,14)
InChIKeyRRTVOMCAWASLFH-UHFFFAOYSA-N
XLogP0.34
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.24
LogP ≤ 50.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1,4-dioxa-9-azaspiro[4.6]undecan-10-one
CID 146591450
(5R)-7-thia-2-azaspiro[4.4]nonane-1,3-dione
CID 51885348
9-methyl-2,9-diazaspiro[4.6]undecane-1,3-dione
CID 65071381
2-aza-8-azoniaspiro[4.5]decane-1,3-dione
CID 143722257
7,7,9,9-tetramethyl-2-azaspiro[4.5]decane-1,3-dione
CID 112682590
(7S)-7-(methoxymethyl)-7-methyl-1,4-dioxaspiro[4.5]decane
CID 129379894
9-azaspiro[6.10]heptadecane-8,10-dione
CID 69440147
9-propan-2-yl-2,9-diazaspiro[4.6]undecane-1,3-dione
CID 65075899
9,12-dioxa-3-azadispiro[4.2.48.25]tetradecan-4-one
CID 58230108
3-(7-methyl-1,4-dioxaspiro[4.5]decan-7-yl)propanal
CID 10632335
8-(trifluoromethyl)-2-azaspiro[4.5]decane-1,3-dione
CID 64754037
7-(2-methylpropyl)-2-azaspiro[4.5]decane-1,3-dione
CID 107429486

Frequently Asked Questions

What is the IUPAC name of 8,11-dioxa-3-azadispiro[4.1.47.35]tetradecane-2,4-dione?
The IUPAC name of 8,11-dioxa-3-azadispiro[4.1.47.35]tetradecane-2,4-dione (CID 58382565) is 8,11-dioxa-3-azadispiro[4.1.47.35]tetradecane-2,4-dione.
What is the SMILES notation for 8,11-dioxa-3-azadispiro[4.1.47.35]tetradecane-2,4-dione?
The canonical SMILES for 8,11-dioxa-3-azadispiro[4.1.47.35]tetradecane-2,4-dione is O=C1CC2(CCCC3(C2)OCCO3)C(=O)N1.
What is the InChIKey of 8,11-dioxa-3-azadispiro[4.1.47.35]tetradecane-2,4-dione?
The InChIKey is RRTVOMCAWASLFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO4/c13-8-6-10(9(14)12-8)2-1-3-11(7-10)15-4-5-16-11/h1-7H2,(H,12,13,14).
What are the key properties of 8,11-dioxa-3-azadispiro[4.1.47.35]tetradecane-2,4-dione?
8,11-dioxa-3-azadispiro[4.1.47.35]tetradecane-2,4-dione has a molecular weight of 225.24 g/mol, XLogP of 0.34, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8,11-dioxa-3-azadispiro[4.1.47.35]tetradecane-2,4-dione is sourced from PubChem (CID 58382565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).