ethyl 2-[(8R)-10-oxo-8-phenyl-6,9-diazaspiro[4.5]decan-4-yl]acetate

C18H24N2O3 — CID 141188776

IUPACethyl 2-[(8R)-10-oxo-8-phenyl-6,9-diazaspiro[4.5]decan-4-yl]acetate
SMILESCCOC(=O)CC1CCCC12NC[C@@H](c1ccccc1)NC2=O
InChIInChI=1S/C18H24N2O3/c1-2-23-16(21)11-14-9-6-10-18(14)17(22)20-15(12-19-18)13-7-4-3-5-8-13/h3-5,7-8,14-15,19H,2,6,9-12H2,1H3,(H,20,22)/t14?,15-,18?/m0/s1
InChIKeyHFSHNZCTJLNHMJ-CSLYMUCUSA-N
MW316.40 g/mol
LogP1.94
Rot. Bonds4

About ethyl 2-[(8R)-10-oxo-8-phenyl-6,9-diazaspiro[4.5]decan-4-yl]acetate

ethyl 2-[(8R)-10-oxo-8-phenyl-6,9-diazaspiro[4.5]decan-4-yl]acetate (PubChem CID 141188776) has the molecular formula C18H24N2O3 and a molecular weight of 316.40 g/mol. Its IUPAC name is ethyl 2-[(8R)-10-oxo-8-phenyl-6,9-diazaspiro[4.5]decan-4-yl]acetate.

Molecular Properties

Compound Nameethyl 2-[(8R)-10-oxo-8-phenyl-6,9-diazaspiro[4.5]decan-4-yl]acetate
PubChem CID141188776
Molecular FormulaC18H24N2O3
Molecular Weight316.40 g/mol
Exact Mass316.18
IUPAC Nameethyl 2-[(8R)-10-oxo-8-phenyl-6,9-diazaspiro[4.5]decan-4-yl]acetate
SMILESCCOC(=O)CC1CCCC12NC[C@@H](c1ccccc1)NC2=O
InChIInChI=1S/C18H24N2O3/c1-2-23-16(21)11-14-9-6-10-18(14)17(22)20-15(12-19-18)13-7-4-3-5-8-13/h3-5,7-8,14-15,19H,2,6,9-12H2,1H3,(H,20,22)/t14?,15-,18?/m0/s1
InChIKeyHFSHNZCTJLNHMJ-CSLYMUCUSA-N
XLogP1.94
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.40
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze ethyl 2-[(8R)-10-oxo-8-phenyl-6,9-diazaspiro[4.5]decan-4-yl]acetate with MolForge

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Related Compounds

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ethyl 2-[(2S,3S,6S)-4-oxo-2,6-diphenylpiperidin-3-yl]acetate
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ethyl 2-(1,4-dioxospiro[4.5]decan-10-yl)acetate
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ethyl 2-[(1S)-2,2-difluorocyclohexyl]acetate
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ethyl 2-(2-oxo-3,4-dihydro-1H-quinazolin-4-yl)acetate
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ethyl 2-(2,3-diphenylcycloprop-2-en-1-yl)acetate
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ethyl 2-(1,3-dioxoinden-2-yl)acetate
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ethyl (3S,4S,5S)-2-oxo-4,5-diphenylpyrrolidine-3-carboxylate
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ethyl 2-(4-benzyl-4-hydroxycyclohexyl)acetate
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2-methyl-4-phenylimidazolidine-2-carboxylic acid
CID 68755333

Frequently Asked Questions

What is the IUPAC name of ethyl 2-[(8R)-10-oxo-8-phenyl-6,9-diazaspiro[4.5]decan-4-yl]acetate?
The IUPAC name of ethyl 2-[(8R)-10-oxo-8-phenyl-6,9-diazaspiro[4.5]decan-4-yl]acetate (CID 141188776) is ethyl 2-[(8R)-10-oxo-8-phenyl-6,9-diazaspiro[4.5]decan-4-yl]acetate.
What is the SMILES notation for ethyl 2-[(8R)-10-oxo-8-phenyl-6,9-diazaspiro[4.5]decan-4-yl]acetate?
The canonical SMILES for ethyl 2-[(8R)-10-oxo-8-phenyl-6,9-diazaspiro[4.5]decan-4-yl]acetate is CCOC(=O)CC1CCCC12NC[C@@H](c1ccccc1)NC2=O.
What is the InChIKey of ethyl 2-[(8R)-10-oxo-8-phenyl-6,9-diazaspiro[4.5]decan-4-yl]acetate?
The InChIKey is HFSHNZCTJLNHMJ-CSLYMUCUSA-N. The full InChI is InChI=1S/C18H24N2O3/c1-2-23-16(21)11-14-9-6-10-18(14)17(22)20-15(12-19-18)13-7-4-3-5-8-13/h3-5,7-8,14-15,19H,2,6,9-12H2,1H3,(H,20,22)/t14?,15-,18?/m0/s1.
What are the key properties of ethyl 2-[(8R)-10-oxo-8-phenyl-6,9-diazaspiro[4.5]decan-4-yl]acetate?
ethyl 2-[(8R)-10-oxo-8-phenyl-6,9-diazaspiro[4.5]decan-4-yl]acetate has a molecular weight of 316.40 g/mol, XLogP of 1.94, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-[(8R)-10-oxo-8-phenyl-6,9-diazaspiro[4.5]decan-4-yl]acetate is sourced from PubChem (CID 141188776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).