7,7,9,9-tetramethyl-3-oxo-2,4-dipropyl-1-oxa-4,8-diazaspiro[4.5]decane-2-carboxamide

C18H33N3O3 — CID 150354096

IUPAC7,7,9,9-tetramethyl-3-oxo-2,4-dipropyl-1-oxa-4,8-diazaspiro[4.5]decane-2-carboxamide
SMILESCCCN1C(=O)C(CCC)(C(N)=O)OC12CC(C)(C)NC(C)(C)C2
InChIInChI=1S/C18H33N3O3/c1-7-9-18(13(19)22)14(23)21(10-8-2)17(24-18)11-15(3,4)20-16(5,6)12-17/h20H,7-12H2,1-6H3,(H2,19,22)
InChIKeyGUITVMQYNYPKIY-UHFFFAOYSA-N
MW339.48 g/mol
LogP1.92
Rot. Bonds5

About 7,7,9,9-tetramethyl-3-oxo-2,4-dipropyl-1-oxa-4,8-diazaspiro[4.5]decane-2-carboxamide

7,7,9,9-tetramethyl-3-oxo-2,4-dipropyl-1-oxa-4,8-diazaspiro[4.5]decane-2-carboxamide (PubChem CID 150354096) has the molecular formula C18H33N3O3 and a molecular weight of 339.48 g/mol. Its IUPAC name is 7,7,9,9-tetramethyl-3-oxo-2,4-dipropyl-1-oxa-4,8-diazaspiro[4.5]decane-2-carboxamide.

Molecular Properties

Compound Name7,7,9,9-tetramethyl-3-oxo-2,4-dipropyl-1-oxa-4,8-diazaspiro[4.5]decane-2-carboxamide
PubChem CID150354096
Molecular FormulaC18H33N3O3
Molecular Weight339.48 g/mol
Exact Mass339.25
IUPAC Name7,7,9,9-tetramethyl-3-oxo-2,4-dipropyl-1-oxa-4,8-diazaspiro[4.5]decane-2-carboxamide
SMILESCCCN1C(=O)C(CCC)(C(N)=O)OC12CC(C)(C)NC(C)(C)C2
InChIInChI=1S/C18H33N3O3/c1-7-9-18(13(19)22)14(23)21(10-8-2)17(24-18)11-15(3,4)20-16(5,6)12-17/h20H,7-12H2,1-6H3,(H2,19,22)
InChIKeyGUITVMQYNYPKIY-UHFFFAOYSA-N
XLogP1.92
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.48
LogP ≤ 51.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

Analyze 7,7,9,9-tetramethyl-3-oxo-2,4-dipropyl-1-oxa-4,8-diazaspiro[4.5]decane-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 7,7,9,9-tetramethyl-3-oxo-2,4-dipropyl-1-oxa-4,8-diazaspiro[4.5]decane-2-carboxamide?
The IUPAC name of 7,7,9,9-tetramethyl-3-oxo-2,4-dipropyl-1-oxa-4,8-diazaspiro[4.5]decane-2-carboxamide (CID 150354096) is 7,7,9,9-tetramethyl-3-oxo-2,4-dipropyl-1-oxa-4,8-diazaspiro[4.5]decane-2-carboxamide.
What is the SMILES notation for 7,7,9,9-tetramethyl-3-oxo-2,4-dipropyl-1-oxa-4,8-diazaspiro[4.5]decane-2-carboxamide?
The canonical SMILES for 7,7,9,9-tetramethyl-3-oxo-2,4-dipropyl-1-oxa-4,8-diazaspiro[4.5]decane-2-carboxamide is CCCN1C(=O)C(CCC)(C(N)=O)OC12CC(C)(C)NC(C)(C)C2.
What is the InChIKey of 7,7,9,9-tetramethyl-3-oxo-2,4-dipropyl-1-oxa-4,8-diazaspiro[4.5]decane-2-carboxamide?
The InChIKey is GUITVMQYNYPKIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H33N3O3/c1-7-9-18(13(19)22)14(23)21(10-8-2)17(24-18)11-15(3,4)20-16(5,6)12-17/h20H,7-12H2,1-6H3,(H2,19,22).
What are the key properties of 7,7,9,9-tetramethyl-3-oxo-2,4-dipropyl-1-oxa-4,8-diazaspiro[4.5]decane-2-carboxamide?
7,7,9,9-tetramethyl-3-oxo-2,4-dipropyl-1-oxa-4,8-diazaspiro[4.5]decane-2-carboxamide has a molecular weight of 339.48 g/mol, XLogP of 1.92, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7,7,9,9-tetramethyl-3-oxo-2,4-dipropyl-1-oxa-4,8-diazaspiro[4.5]decane-2-carboxamide is sourced from PubChem (CID 150354096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).