9-(2-methoxyethyl)-1-(3-phenylpropyl)-1,9-diazaspiro[4.5]decan-10-one

C20H30N2O2 — CID 162627579

IUPAC9-(2-methoxyethyl)-1-(3-phenylpropyl)-1,9-diazaspiro[4.5]decan-10-one
SMILESCOCCN1CCCC2(CCCN2CCCc2ccccc2)C1=O
InChIInChI=1S/C20H30N2O2/c1-24-17-16-21-13-6-11-20(19(21)23)12-7-15-22(20)14-5-10-18-8-3-2-4-9-18/h2-4,8-9H,5-7,10-17H2,1H3
InChIKeyZAXAXJMAIFQMSO-UHFFFAOYSA-N
MW330.47 g/mol
LogP2.72
Rot. Bonds7

About 9-(2-methoxyethyl)-1-(3-phenylpropyl)-1,9-diazaspiro[4.5]decan-10-one

9-(2-methoxyethyl)-1-(3-phenylpropyl)-1,9-diazaspiro[4.5]decan-10-one (PubChem CID 162627579) has the molecular formula C20H30N2O2 and a molecular weight of 330.47 g/mol. Its IUPAC name is 9-(2-methoxyethyl)-1-(3-phenylpropyl)-1,9-diazaspiro[4.5]decan-10-one.

Molecular Properties

Compound Name9-(2-methoxyethyl)-1-(3-phenylpropyl)-1,9-diazaspiro[4.5]decan-10-one
PubChem CID162627579
Molecular FormulaC20H30N2O2
Molecular Weight330.47 g/mol
Exact Mass330.23
IUPAC Name9-(2-methoxyethyl)-1-(3-phenylpropyl)-1,9-diazaspiro[4.5]decan-10-one
SMILESCOCCN1CCCC2(CCCN2CCCc2ccccc2)C1=O
InChIInChI=1S/C20H30N2O2/c1-24-17-16-21-13-6-11-20(19(21)23)12-7-15-22(20)14-5-10-18-8-3-2-4-9-18/h2-4,8-9H,5-7,10-17H2,1H3
InChIKeyZAXAXJMAIFQMSO-UHFFFAOYSA-N
XLogP2.72
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.47
LogP ≤ 52.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-methoxyethyl)-7-(3-phenylpropyl)-2,7-diazaspiro[4.4]nonan-1-one
CID 176502457
1-(1-benzothiophen-3-ylmethyl)-9-(2-methoxyethyl)-1,9-diazaspiro[4.5]decan-10-one
CID 157012169
4-[[10-oxo-9-(2-phenylethyl)-1,9-diazaspiro[4.5]decan-1-yl]methyl]benzonitrile
CID 162626493
9-(2-methoxyethyl)-1-[(E)-3-phenylprop-2-enoyl]-1,9-diazaspiro[4.5]decan-10-one
CID 162626207
1-[(2-chloro-3-hydroxyphenyl)methyl]-9-(2-phenylethyl)-1,9-diazaspiro[4.5]decan-10-one
CID 162634689
1-[[3-fluoro-5-(trifluoromethyl)phenyl]methyl]-9-(2-methoxyethyl)-1,9-diazaspiro[4.5]decan-10-one
CID 162626916
1-[(4-chloro-2-fluorophenyl)methyl]-9-(2-phenylethyl)-1,9-diazaspiro[4.5]decan-10-one
CID 162625681
1-(2-methoxyethyl)-9-(4-methylphenyl)-1,9-diazaspiro[4.5]decan-10-one
CID 162627312
9-benzyl-1-[(4-chlorophenyl)methyl]-1,9-diazaspiro[4.5]decan-10-one
CID 163317012
2-(2-methoxyethyl)-9-(2-phenylacetyl)-2,9-diazaspiro[4.6]undecan-1-one
CID 131680101
1-(3-phenylpropanoyl)-9-propyl-1,9-diazaspiro[4.5]decan-10-one
CID 162638324
9-(2-methoxyethyl)-1-(4-methoxyphenyl)sulfonyl-1,9-diazaspiro[4.5]decan-10-one
CID 162635414

Frequently Asked Questions

What is the IUPAC name of 9-(2-methoxyethyl)-1-(3-phenylpropyl)-1,9-diazaspiro[4.5]decan-10-one?
The IUPAC name of 9-(2-methoxyethyl)-1-(3-phenylpropyl)-1,9-diazaspiro[4.5]decan-10-one (CID 162627579) is 9-(2-methoxyethyl)-1-(3-phenylpropyl)-1,9-diazaspiro[4.5]decan-10-one.
What is the SMILES notation for 9-(2-methoxyethyl)-1-(3-phenylpropyl)-1,9-diazaspiro[4.5]decan-10-one?
The canonical SMILES for 9-(2-methoxyethyl)-1-(3-phenylpropyl)-1,9-diazaspiro[4.5]decan-10-one is COCCN1CCCC2(CCCN2CCCc2ccccc2)C1=O.
What is the InChIKey of 9-(2-methoxyethyl)-1-(3-phenylpropyl)-1,9-diazaspiro[4.5]decan-10-one?
The InChIKey is ZAXAXJMAIFQMSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H30N2O2/c1-24-17-16-21-13-6-11-20(19(21)23)12-7-15-22(20)14-5-10-18-8-3-2-4-9-18/h2-4,8-9H,5-7,10-17H2,1H3.
What are the key properties of 9-(2-methoxyethyl)-1-(3-phenylpropyl)-1,9-diazaspiro[4.5]decan-10-one?
9-(2-methoxyethyl)-1-(3-phenylpropyl)-1,9-diazaspiro[4.5]decan-10-one has a molecular weight of 330.47 g/mol, XLogP of 2.72, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(2-methoxyethyl)-1-(3-phenylpropyl)-1,9-diazaspiro[4.5]decan-10-one is sourced from PubChem (CID 162627579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).