9-methyl-1-(2-phenoxyacetyl)-1,9-diazaspiro[4.5]decan-10-one

C17H22N2O3 — CID 164698220

IUPAC9-methyl-1-(2-phenoxyacetyl)-1,9-diazaspiro[4.5]decan-10-one
SMILESCN1CCCC2(CCCN2C(=O)COc2ccccc2)C1=O
InChIInChI=1S/C17H22N2O3/c1-18-11-5-9-17(16(18)21)10-6-12-19(17)15(20)13-22-14-7-3-2-4-8-14/h2-4,7-8H,5-6,9-13H2,1H3
InChIKeyGQRZMALROQXVBR-UHFFFAOYSA-N
MW302.37 g/mol
LogP1.68
Rot. Bonds3

About 9-methyl-1-(2-phenoxyacetyl)-1,9-diazaspiro[4.5]decan-10-one

9-methyl-1-(2-phenoxyacetyl)-1,9-diazaspiro[4.5]decan-10-one (PubChem CID 164698220) has the molecular formula C17H22N2O3 and a molecular weight of 302.37 g/mol. Its IUPAC name is 9-methyl-1-(2-phenoxyacetyl)-1,9-diazaspiro[4.5]decan-10-one.

Molecular Properties

Compound Name9-methyl-1-(2-phenoxyacetyl)-1,9-diazaspiro[4.5]decan-10-one
PubChem CID164698220
Molecular FormulaC17H22N2O3
Molecular Weight302.37 g/mol
Exact Mass302.16
IUPAC Name9-methyl-1-(2-phenoxyacetyl)-1,9-diazaspiro[4.5]decan-10-one
SMILESCN1CCCC2(CCCN2C(=O)COc2ccccc2)C1=O
InChIInChI=1S/C17H22N2O3/c1-18-11-5-9-17(16(18)21)10-6-12-19(17)15(20)13-22-14-7-3-2-4-8-14/h2-4,7-8H,5-6,9-13H2,1H3
InChIKeyGQRZMALROQXVBR-UHFFFAOYSA-N
XLogP1.68
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.37
LogP ≤ 51.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

9-methyl-1-(3-methyl-3-phenylbutanoyl)-1,9-diazaspiro[4.5]decan-10-one
CID 162631432
1-[2-(3-methoxyphenyl)acetyl]-9-methyl-1,9-diazaspiro[4.5]decan-10-one
CID 162627422
9-methyl-1-(4-phenylbenzoyl)-1,9-diazaspiro[4.5]decan-10-one
CID 162635147
formic acid;9-methyl-1-[2-(2-oxo-1-pyridinyl)acetyl]-1,9-diazaspiro[4.5]decan-10-one
CID 166598201
1-[2-(3-methoxyphenoxy)acetyl]-1,9-diazaspiro[4.5]decan-10-one
CID 163310700
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CID 3053844
1-[2-(3,4-dimethylphenoxy)acetyl]-1,9-diazaspiro[4.5]decan-10-one
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CID 95848343
1-(6-azaspiro[2.5]octan-6-yl)-2-phenoxyethanone
CID 97399323
9-methyl-1-(quinoline-6-carbonyl)-1,9-diazaspiro[4.5]decan-10-one
CID 162633720
1-[(4aS,8aS)-5,8a-dimethyl-3,4,4a,6,7,8-hexahydro-2H-1,5-naphthyridin-1-yl]-2-(2-methylphenoxy)ethanone
CID 110141523

Frequently Asked Questions

What is the IUPAC name of 9-methyl-1-(2-phenoxyacetyl)-1,9-diazaspiro[4.5]decan-10-one?
The IUPAC name of 9-methyl-1-(2-phenoxyacetyl)-1,9-diazaspiro[4.5]decan-10-one (CID 164698220) is 9-methyl-1-(2-phenoxyacetyl)-1,9-diazaspiro[4.5]decan-10-one.
What is the SMILES notation for 9-methyl-1-(2-phenoxyacetyl)-1,9-diazaspiro[4.5]decan-10-one?
The canonical SMILES for 9-methyl-1-(2-phenoxyacetyl)-1,9-diazaspiro[4.5]decan-10-one is CN1CCCC2(CCCN2C(=O)COc2ccccc2)C1=O.
What is the InChIKey of 9-methyl-1-(2-phenoxyacetyl)-1,9-diazaspiro[4.5]decan-10-one?
The InChIKey is GQRZMALROQXVBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O3/c1-18-11-5-9-17(16(18)21)10-6-12-19(17)15(20)13-22-14-7-3-2-4-8-14/h2-4,7-8H,5-6,9-13H2,1H3.
What are the key properties of 9-methyl-1-(2-phenoxyacetyl)-1,9-diazaspiro[4.5]decan-10-one?
9-methyl-1-(2-phenoxyacetyl)-1,9-diazaspiro[4.5]decan-10-one has a molecular weight of 302.37 g/mol, XLogP of 1.68, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-methyl-1-(2-phenoxyacetyl)-1,9-diazaspiro[4.5]decan-10-one is sourced from PubChem (CID 164698220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).