8-(2-methoxyethyl)-1-methyl-3-phenyl-1,8-diazaspiro[4.5]decan-2-one

C18H26N2O2 — CID 72911583

IUPAC8-(2-methoxyethyl)-1-methyl-3-phenyl-1,8-diazaspiro[4.5]decan-2-one
SMILESCOCCN1CCC2(CC1)CC(c1ccccc1)C(=O)N2C
InChIInChI=1S/C18H26N2O2/c1-19-17(21)16(15-6-4-3-5-7-15)14-18(19)8-10-20(11-9-18)12-13-22-2/h3-7,16H,8-14H2,1-2H3
InChIKeyNOMSXVCDPUAYLE-UHFFFAOYSA-N
MW302.42 g/mol
LogP2.11
Rot. Bonds4

About 8-(2-methoxyethyl)-1-methyl-3-phenyl-1,8-diazaspiro[4.5]decan-2-one

8-(2-methoxyethyl)-1-methyl-3-phenyl-1,8-diazaspiro[4.5]decan-2-one (PubChem CID 72911583) has the molecular formula C18H26N2O2 and a molecular weight of 302.42 g/mol. Its IUPAC name is 8-(2-methoxyethyl)-1-methyl-3-phenyl-1,8-diazaspiro[4.5]decan-2-one.

Molecular Properties

Compound Name8-(2-methoxyethyl)-1-methyl-3-phenyl-1,8-diazaspiro[4.5]decan-2-one
PubChem CID72911583
Molecular FormulaC18H26N2O2
Molecular Weight302.42 g/mol
Exact Mass302.20
IUPAC Name8-(2-methoxyethyl)-1-methyl-3-phenyl-1,8-diazaspiro[4.5]decan-2-one
SMILESCOCCN1CCC2(CC1)CC(c1ccccc1)C(=O)N2C
InChIInChI=1S/C18H26N2O2/c1-19-17(21)16(15-6-4-3-5-7-15)14-18(19)8-10-20(11-9-18)12-13-22-2/h3-7,16H,8-14H2,1-2H3
InChIKeyNOMSXVCDPUAYLE-UHFFFAOYSA-N
XLogP2.11
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.42
LogP ≤ 52.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 8-(2-methoxyethyl)-1-methyl-3-phenyl-1,8-diazaspiro[4.5]decan-2-one?
The IUPAC name of 8-(2-methoxyethyl)-1-methyl-3-phenyl-1,8-diazaspiro[4.5]decan-2-one (CID 72911583) is 8-(2-methoxyethyl)-1-methyl-3-phenyl-1,8-diazaspiro[4.5]decan-2-one.
What is the SMILES notation for 8-(2-methoxyethyl)-1-methyl-3-phenyl-1,8-diazaspiro[4.5]decan-2-one?
The canonical SMILES for 8-(2-methoxyethyl)-1-methyl-3-phenyl-1,8-diazaspiro[4.5]decan-2-one is COCCN1CCC2(CC1)CC(c1ccccc1)C(=O)N2C.
What is the InChIKey of 8-(2-methoxyethyl)-1-methyl-3-phenyl-1,8-diazaspiro[4.5]decan-2-one?
The InChIKey is NOMSXVCDPUAYLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O2/c1-19-17(21)16(15-6-4-3-5-7-15)14-18(19)8-10-20(11-9-18)12-13-22-2/h3-7,16H,8-14H2,1-2H3.
What are the key properties of 8-(2-methoxyethyl)-1-methyl-3-phenyl-1,8-diazaspiro[4.5]decan-2-one?
8-(2-methoxyethyl)-1-methyl-3-phenyl-1,8-diazaspiro[4.5]decan-2-one has a molecular weight of 302.42 g/mol, XLogP of 2.11, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(2-methoxyethyl)-1-methyl-3-phenyl-1,8-diazaspiro[4.5]decan-2-one is sourced from PubChem (CID 72911583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).