8-methyl-3-phenyl-1,4-diazaspiro[4.5]dec-3-en-2-one

C15H18N2O — CID 51358725

IUPAC8-methyl-3-phenyl-1,4-diazaspiro[4.5]dec-3-en-2-one
SMILESCC1CCC2(CC1)N=C(c1ccccc1)C(=O)N2
InChIInChI=1S/C15H18N2O/c1-11-7-9-15(10-8-11)16-13(14(18)17-15)12-5-3-2-4-6-12/h2-6,11H,7-10H2,1H3,(H,17,18)
InChIKeyBEDOAEXLFNFZNW-UHFFFAOYSA-N
MW242.32 g/mol
LogP2.51
Rot. Bonds1

About 8-methyl-3-phenyl-1,4-diazaspiro[4.5]dec-3-en-2-one

8-methyl-3-phenyl-1,4-diazaspiro[4.5]dec-3-en-2-one (PubChem CID 51358725) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is 8-methyl-3-phenyl-1,4-diazaspiro[4.5]dec-3-en-2-one.

Molecular Properties

Compound Name8-methyl-3-phenyl-1,4-diazaspiro[4.5]dec-3-en-2-one
PubChem CID51358725
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Name8-methyl-3-phenyl-1,4-diazaspiro[4.5]dec-3-en-2-one
SMILESCC1CCC2(CC1)N=C(c1ccccc1)C(=O)N2
InChIInChI=1S/C15H18N2O/c1-11-7-9-15(10-8-11)16-13(14(18)17-15)12-5-3-2-4-6-12/h2-6,11H,7-10H2,1H3,(H,17,18)
InChIKeyBEDOAEXLFNFZNW-UHFFFAOYSA-N
XLogP2.51
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Desaminometamitron
CID 135413636
3-Phenyl-1,4-diazaspiro[4.5]dec-3-en-2-one
CID 3242855
5-(3-fluorophenyl)-2,2-dimethyl-2,3-dihydro-4H-imidazol-4-one
CID 3240492
5-(4-chlorophenyl)-2,2-dimethyl-2,3-dihydro-4H-imidazol-4-one
CID 3240911
3-(4-Fluorophenyl)-1,4-diazaspiro[4.4]non-3-en-2-one
CID 9550199
3-(4-Fluorophenyl)-1,4-diazaspiro[4.6]undec-3-en-2-one
CID 9550650
2,2-dimethyl-5-(4-methylphenyl)-2,3-dihydro-4H-imidazol-4-one
CID 9550805
3-(4-Bromophenyl)-1,4-diazaspiro[4.5]dec-3-en-2-one
CID 9550806
3-(4-Fluorophenyl)-1,4-diazaspiro[4.5]dec-3-en-2-one
CID 3242267
2,2-dimethyl-5-phenyl-2,3-dihydro-4H-imidazol-4-one
CID 6621552
3-(4-Methylphenyl)-1,4-diazaspiro[4.5]dec-3-en-2-one
CID 22428769
8-Tert-butyl-3-(3-fluorophenyl)-1,4-diazaspiro[4.5]dec-3-en-2-one
CID 22428591

Frequently Asked Questions

What is the IUPAC name of 8-methyl-3-phenyl-1,4-diazaspiro[4.5]dec-3-en-2-one?
The IUPAC name of 8-methyl-3-phenyl-1,4-diazaspiro[4.5]dec-3-en-2-one (CID 51358725) is 8-methyl-3-phenyl-1,4-diazaspiro[4.5]dec-3-en-2-one.
What is the SMILES notation for 8-methyl-3-phenyl-1,4-diazaspiro[4.5]dec-3-en-2-one?
The canonical SMILES for 8-methyl-3-phenyl-1,4-diazaspiro[4.5]dec-3-en-2-one is CC1CCC2(CC1)N=C(c1ccccc1)C(=O)N2.
What is the InChIKey of 8-methyl-3-phenyl-1,4-diazaspiro[4.5]dec-3-en-2-one?
The InChIKey is BEDOAEXLFNFZNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-11-7-9-15(10-8-11)16-13(14(18)17-15)12-5-3-2-4-6-12/h2-6,11H,7-10H2,1H3,(H,17,18).
What are the key properties of 8-methyl-3-phenyl-1,4-diazaspiro[4.5]dec-3-en-2-one?
8-methyl-3-phenyl-1,4-diazaspiro[4.5]dec-3-en-2-one has a molecular weight of 242.32 g/mol, XLogP of 2.51, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-3-phenyl-1,4-diazaspiro[4.5]dec-3-en-2-one is sourced from PubChem (CID 51358725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).