8-methoxy-2-(2-methylpropylimino)-1,3-diazaspiro[4.5]decan-4-one

C13H23N3O2 — CID 136951383

IUPAC8-methoxy-2-(2-methylpropylimino)-1,3-diazaspiro[4.5]decan-4-one
SMILESCOC1CCC2(CC1)N/C(=N/CC(C)C)NC2=O
InChIInChI=1S/C13H23N3O2/c1-9(2)8-14-12-15-11(17)13(16-12)6-4-10(18-3)5-7-13/h9-10H,4-8H2,1-3H3,(H2,14,15,16,17)
InChIKeyCUZPHIQELYPKDJ-UHFFFAOYSA-N
MW253.35 g/mol
LogP1.05
Rot. Bonds3

About 8-methoxy-2-(2-methylpropylimino)-1,3-diazaspiro[4.5]decan-4-one

8-methoxy-2-(2-methylpropylimino)-1,3-diazaspiro[4.5]decan-4-one (PubChem CID 136951383) has the molecular formula C13H23N3O2 and a molecular weight of 253.35 g/mol. Its IUPAC name is 8-methoxy-2-(2-methylpropylimino)-1,3-diazaspiro[4.5]decan-4-one.

Molecular Properties

Compound Name8-methoxy-2-(2-methylpropylimino)-1,3-diazaspiro[4.5]decan-4-one
PubChem CID136951383
Molecular FormulaC13H23N3O2
Molecular Weight253.35 g/mol
Exact Mass253.18
IUPAC Name8-methoxy-2-(2-methylpropylimino)-1,3-diazaspiro[4.5]decan-4-one
SMILESCOC1CCC2(CC1)N/C(=N/CC(C)C)NC2=O
InChIInChI=1S/C13H23N3O2/c1-9(2)8-14-12-15-11(17)13(16-12)6-4-10(18-3)5-7-13/h9-10H,4-8H2,1-3H3,(H2,14,15,16,17)
InChIKeyCUZPHIQELYPKDJ-UHFFFAOYSA-N
XLogP1.05
TPSA62.72 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.35
LogP ≤ 51.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 8-methoxy-2-(2-methylpropylimino)-1,3-diazaspiro[4.5]decan-4-one with MolForge

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

Launch Full Analysis

Related Compounds

2'-(2-methylpropylimino)spiro[1,3-dihydroisochromene-4,5'-imidazolidine]-4'-one
CID 136703807
2-(cyclohexylmethylimino)-8-methoxy-1-thia-3-azaspiro[4.5]decan-4-one
CID 135989077
2-cyclopropylimino-7-(2-methylpropyl)-1,3-diazaspiro[4.5]decan-4-one
CID 136734054
ethyl 8-methoxy-2,4-dioxo-1-azaspiro[4.5]decane-3-carboxylate
CID 123163602
8-acetyl-2-ethylimino-1,3,8-triazaspiro[4.5]decan-4-one
CID 136932075
8-methoxy-1-oxa-3-azaspiro[4.5]decan-2-one
CID 112704509
(1R,4S)-1,7,7-trimethyl-3-(2-methylpropylimino)bicyclo[2.2.1]heptan-2-one
CID 10262951
CID 90938884
CID 90938884
3-[4-chloro-2-ethyl-6-(2-methylpropoxy)phenyl]-4-hydroxy-8-methoxy-1-azaspiro[4.5]dec-3-en-2-one
CID 58795512
3-(2-bromo-5-methylphenyl)-8-methoxy-1-azaspiro[4.5]decane-2,4-dione
CID 77256763
(7S)-7-(2-methylpropyl)-5,8-diazaspiro[3.5]nonane-6,9-dione
CID 11820437
CID 70216327
CID 70216327

Frequently Asked Questions

What is the IUPAC name of 8-methoxy-2-(2-methylpropylimino)-1,3-diazaspiro[4.5]decan-4-one?
The IUPAC name of 8-methoxy-2-(2-methylpropylimino)-1,3-diazaspiro[4.5]decan-4-one (CID 136951383) is 8-methoxy-2-(2-methylpropylimino)-1,3-diazaspiro[4.5]decan-4-one.
What is the SMILES notation for 8-methoxy-2-(2-methylpropylimino)-1,3-diazaspiro[4.5]decan-4-one?
The canonical SMILES for 8-methoxy-2-(2-methylpropylimino)-1,3-diazaspiro[4.5]decan-4-one is COC1CCC2(CC1)N/C(=N/CC(C)C)NC2=O.
What is the InChIKey of 8-methoxy-2-(2-methylpropylimino)-1,3-diazaspiro[4.5]decan-4-one?
The InChIKey is CUZPHIQELYPKDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O2/c1-9(2)8-14-12-15-11(17)13(16-12)6-4-10(18-3)5-7-13/h9-10H,4-8H2,1-3H3,(H2,14,15,16,17).
What are the key properties of 8-methoxy-2-(2-methylpropylimino)-1,3-diazaspiro[4.5]decan-4-one?
8-methoxy-2-(2-methylpropylimino)-1,3-diazaspiro[4.5]decan-4-one has a molecular weight of 253.35 g/mol, XLogP of 1.05, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methoxy-2-(2-methylpropylimino)-1,3-diazaspiro[4.5]decan-4-one is sourced from PubChem (CID 136951383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).