9-(2-methoxyethyl)-1-(4-methoxyphenyl)sulfonyl-1,9-diazaspiro[4.5]decan-10-one

C18H26N2O5S — CID 162635414

IUPAC9-(2-methoxyethyl)-1-(4-methoxyphenyl)sulfonyl-1,9-diazaspiro[4.5]decan-10-one
SMILESCOCCN1CCCC2(CCCN2S(=O)(=O)c2ccc(OC)cc2)C1=O
InChIInChI=1S/C18H26N2O5S/c1-24-14-13-19-11-3-9-18(17(19)21)10-4-12-20(18)26(22,23)16-7-5-15(25-2)6-8-16/h5-8H,3-4,9-14H2,1-2H3
InChIKeyGDMNWNVWZOJNNC-UHFFFAOYSA-N
MW382.48 g/mol
LogP1.49
Rot. Bonds6

About 9-(2-methoxyethyl)-1-(4-methoxyphenyl)sulfonyl-1,9-diazaspiro[4.5]decan-10-one

9-(2-methoxyethyl)-1-(4-methoxyphenyl)sulfonyl-1,9-diazaspiro[4.5]decan-10-one (PubChem CID 162635414) has the molecular formula C18H26N2O5S and a molecular weight of 382.48 g/mol. Its IUPAC name is 9-(2-methoxyethyl)-1-(4-methoxyphenyl)sulfonyl-1,9-diazaspiro[4.5]decan-10-one.

Molecular Properties

Compound Name9-(2-methoxyethyl)-1-(4-methoxyphenyl)sulfonyl-1,9-diazaspiro[4.5]decan-10-one
PubChem CID162635414
Molecular FormulaC18H26N2O5S
Molecular Weight382.48 g/mol
Exact Mass382.16
IUPAC Name9-(2-methoxyethyl)-1-(4-methoxyphenyl)sulfonyl-1,9-diazaspiro[4.5]decan-10-one
SMILESCOCCN1CCCC2(CCCN2S(=O)(=O)c2ccc(OC)cc2)C1=O
InChIInChI=1S/C18H26N2O5S/c1-24-14-13-19-11-3-9-18(17(19)21)10-4-12-20(18)26(22,23)16-7-5-15(25-2)6-8-16/h5-8H,3-4,9-14H2,1-2H3
InChIKeyGDMNWNVWZOJNNC-UHFFFAOYSA-N
XLogP1.49
TPSA76.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.48
LogP ≤ 51.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-(4-tert-butylphenyl)sulfonyl-9-propyl-1,9-diazaspiro[4.5]decan-10-one
CID 162625655
2-ethyl-1-(4-methoxyphenyl)sulfonylpyrrolidine-2-carboxylic acid
CID 83059060
9-(2-methoxyethyl)-1-(3-phenylpropyl)-1,9-diazaspiro[4.5]decan-10-one
CID 162627579
1-(4-methoxyphenyl)sulfonyl-2-methylpiperidine-2-carboxylic acid
CID 104595640
9-(2-methoxyethyl)-1-[1-(4-methylphenyl)cyclopropanecarbonyl]-1,9-diazaspiro[4.5]decan-10-one
CID 162632849
1-(1-benzothiophen-3-ylmethyl)-9-(2-methoxyethyl)-1,9-diazaspiro[4.5]decan-10-one
CID 157012169
9-(2-methoxyethyl)-1-[(E)-3-phenylprop-2-enoyl]-1,9-diazaspiro[4.5]decan-10-one
CID 162626207
1-(3-chloro-4-methoxyphenyl)sulfonyl-9-propan-2-yl-1,9-diazaspiro[4.5]decan-10-one
CID 163314944
(3aS,6aS)-4-(2-methoxyethyl)-1-(4-methoxyphenyl)sulfonyl-3,3a,6,6a-tetrahydro-2H-pyrrolo[3,2-b]pyrrol-5-one
CID 98778727
7-(2-methoxyethyl)-2-pyridin-3-ylsulfonyl-2,7-diazaspiro[4.5]decan-6-one
CID 86286966
1-(2,3-dichlorobenzoyl)-9-(2-methoxyethyl)-1,9-diazaspiro[4.5]decan-10-one
CID 162632388
1-(4,6-dimethylpyrimidine-5-carbonyl)-9-(2-methoxyethyl)-1,9-diazaspiro[4.5]decan-10-one
CID 162636176

Frequently Asked Questions

What is the IUPAC name of 9-(2-methoxyethyl)-1-(4-methoxyphenyl)sulfonyl-1,9-diazaspiro[4.5]decan-10-one?
The IUPAC name of 9-(2-methoxyethyl)-1-(4-methoxyphenyl)sulfonyl-1,9-diazaspiro[4.5]decan-10-one (CID 162635414) is 9-(2-methoxyethyl)-1-(4-methoxyphenyl)sulfonyl-1,9-diazaspiro[4.5]decan-10-one.
What is the SMILES notation for 9-(2-methoxyethyl)-1-(4-methoxyphenyl)sulfonyl-1,9-diazaspiro[4.5]decan-10-one?
The canonical SMILES for 9-(2-methoxyethyl)-1-(4-methoxyphenyl)sulfonyl-1,9-diazaspiro[4.5]decan-10-one is COCCN1CCCC2(CCCN2S(=O)(=O)c2ccc(OC)cc2)C1=O.
What is the InChIKey of 9-(2-methoxyethyl)-1-(4-methoxyphenyl)sulfonyl-1,9-diazaspiro[4.5]decan-10-one?
The InChIKey is GDMNWNVWZOJNNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O5S/c1-24-14-13-19-11-3-9-18(17(19)21)10-4-12-20(18)26(22,23)16-7-5-15(25-2)6-8-16/h5-8H,3-4,9-14H2,1-2H3.
What are the key properties of 9-(2-methoxyethyl)-1-(4-methoxyphenyl)sulfonyl-1,9-diazaspiro[4.5]decan-10-one?
9-(2-methoxyethyl)-1-(4-methoxyphenyl)sulfonyl-1,9-diazaspiro[4.5]decan-10-one has a molecular weight of 382.48 g/mol, XLogP of 1.49, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(2-methoxyethyl)-1-(4-methoxyphenyl)sulfonyl-1,9-diazaspiro[4.5]decan-10-one is sourced from PubChem (CID 162635414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).