8-(2-methylpropanoyl)-1-phenyl-1,8-diazaspiro[4.5]decan-4-one

C18H24N2O2 — CID 167673948

IUPAC8-(2-methylpropanoyl)-1-phenyl-1,8-diazaspiro[4.5]decan-4-one
SMILESCC(C)C(=O)N1CCC2(CC1)C(=O)CCN2c1ccccc1
InChIInChI=1S/C18H24N2O2/c1-14(2)17(22)19-12-9-18(10-13-19)16(21)8-11-20(18)15-6-4-3-5-7-15/h3-7,14H,8-13H2,1-2H3
InChIKeyWBERZJDJMCDWBP-UHFFFAOYSA-N
MW300.40 g/mol
LogP2.48
Rot. Bonds2

About 8-(2-methylpropanoyl)-1-phenyl-1,8-diazaspiro[4.5]decan-4-one

8-(2-methylpropanoyl)-1-phenyl-1,8-diazaspiro[4.5]decan-4-one (PubChem CID 167673948) has the molecular formula C18H24N2O2 and a molecular weight of 300.40 g/mol. Its IUPAC name is 8-(2-methylpropanoyl)-1-phenyl-1,8-diazaspiro[4.5]decan-4-one.

Molecular Properties

Compound Name8-(2-methylpropanoyl)-1-phenyl-1,8-diazaspiro[4.5]decan-4-one
PubChem CID167673948
Molecular FormulaC18H24N2O2
Molecular Weight300.40 g/mol
Exact Mass300.18
IUPAC Name8-(2-methylpropanoyl)-1-phenyl-1,8-diazaspiro[4.5]decan-4-one
SMILESCC(C)C(=O)N1CCC2(CC1)C(=O)CCN2c1ccccc1
InChIInChI=1S/C18H24N2O2/c1-14(2)17(22)19-12-9-18(10-13-19)16(21)8-11-20(18)15-6-4-3-5-7-15/h3-7,14H,8-13H2,1-2H3
InChIKeyWBERZJDJMCDWBP-UHFFFAOYSA-N
XLogP2.48
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.40
LogP ≤ 52.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-phenyl-1-azaspiro[4.5]decan-4-one;hydrochloride
CID 70273507
N-[(2R)-butan-2-yl]-2-[8-(2-methylpropanoyl)-4-oxo-1-phenyl-1,3,8-triazaspiro[4.5]decan-3-yl]acetamide
CID 7306751
(E)-but-2-enedioic acid;8-cyclononyl-1-phenyl-1,8-diazaspiro[4.5]decan-4-one
CID 18002539
8-(1,2,3,3a,4,5,6,7,8,8a-decahydroazulen-2-yl)-1-phenyl-1,8-diazaspiro[4.5]decan-4-one;(E)-but-2-enedioic acid
CID 21268360
8-(2,2-diphenylacetyl)-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one
CID 141234209
1'-(2-methylpropanoyl)spiro[3H-chromene-2,4'-piperidine]-4-one
CID 7260499
2-[4-oxo-1-phenyl-8-(2-phenylbutanoyl)-1,3,8-triazaspiro[4.5]decan-3-yl]-N-propan-2-ylacetamide
CID 3547657
2-[8-(2-ethylhexanoyl)-4-oxo-1-phenyl-1,3,8-triazaspiro[4.5]decan-3-yl]-N-propan-2-ylacetamide
CID 5170433
8-[(2R)-2-amino-3-(4-chlorophenyl)propanoyl]-3-ethyl-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one
CID 70661815
2-cyclopropyl-3-[[4-hydroxy-1-(2-methylpropanoyl)piperidin-4-yl]methyl]quinazolin-4-one
CID 92552853
3-benzyl-4-oxo-1-phenyl-1,3,8-triazaspiro[4.5]decane-8-carboxylic acid
CID 18441745
2-[8-(3-methylbutanoyl)-4-oxo-1-phenyl-1,3,8-triazaspiro[4.5]decan-3-yl]-N-propan-2-ylacetamide
CID 4517571

Frequently Asked Questions

What is the IUPAC name of 8-(2-methylpropanoyl)-1-phenyl-1,8-diazaspiro[4.5]decan-4-one?
The IUPAC name of 8-(2-methylpropanoyl)-1-phenyl-1,8-diazaspiro[4.5]decan-4-one (CID 167673948) is 8-(2-methylpropanoyl)-1-phenyl-1,8-diazaspiro[4.5]decan-4-one.
What is the SMILES notation for 8-(2-methylpropanoyl)-1-phenyl-1,8-diazaspiro[4.5]decan-4-one?
The canonical SMILES for 8-(2-methylpropanoyl)-1-phenyl-1,8-diazaspiro[4.5]decan-4-one is CC(C)C(=O)N1CCC2(CC1)C(=O)CCN2c1ccccc1.
What is the InChIKey of 8-(2-methylpropanoyl)-1-phenyl-1,8-diazaspiro[4.5]decan-4-one?
The InChIKey is WBERZJDJMCDWBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O2/c1-14(2)17(22)19-12-9-18(10-13-19)16(21)8-11-20(18)15-6-4-3-5-7-15/h3-7,14H,8-13H2,1-2H3.
What are the key properties of 8-(2-methylpropanoyl)-1-phenyl-1,8-diazaspiro[4.5]decan-4-one?
8-(2-methylpropanoyl)-1-phenyl-1,8-diazaspiro[4.5]decan-4-one has a molecular weight of 300.40 g/mol, XLogP of 2.48, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(2-methylpropanoyl)-1-phenyl-1,8-diazaspiro[4.5]decan-4-one is sourced from PubChem (CID 167673948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).