8-(furan-2-ylmethyl)-2-methyl-4-phenyl-2,8-diazaspiro[4.5]decan-1-one

C20H24N2O2 — CID 131662088

IUPAC8-(furan-2-ylmethyl)-2-methyl-4-phenyl-2,8-diazaspiro[4.5]decan-1-one
SMILESCN1CC(c2ccccc2)C2(CCN(Cc3ccco3)CC2)C1=O
InChIInChI=1S/C20H24N2O2/c1-21-15-18(16-6-3-2-4-7-16)20(19(21)23)9-11-22(12-10-20)14-17-8-5-13-24-17/h2-8,13,18H,9-12,14-15H2,1H3
InChIKeyIIGPUBGFLMPJLK-UHFFFAOYSA-N
MW324.42 g/mol
LogP3.12
Rot. Bonds3

About 8-(furan-2-ylmethyl)-2-methyl-4-phenyl-2,8-diazaspiro[4.5]decan-1-one

8-(furan-2-ylmethyl)-2-methyl-4-phenyl-2,8-diazaspiro[4.5]decan-1-one (PubChem CID 131662088) has the molecular formula C20H24N2O2 and a molecular weight of 324.42 g/mol. Its IUPAC name is 8-(furan-2-ylmethyl)-2-methyl-4-phenyl-2,8-diazaspiro[4.5]decan-1-one.

Molecular Properties

Compound Name8-(furan-2-ylmethyl)-2-methyl-4-phenyl-2,8-diazaspiro[4.5]decan-1-one
PubChem CID131662088
Molecular FormulaC20H24N2O2
Molecular Weight324.42 g/mol
Exact Mass324.18
IUPAC Name8-(furan-2-ylmethyl)-2-methyl-4-phenyl-2,8-diazaspiro[4.5]decan-1-one
SMILESCN1CC(c2ccccc2)C2(CCN(Cc3ccco3)CC2)C1=O
InChIInChI=1S/C20H24N2O2/c1-21-15-18(16-6-3-2-4-7-16)20(19(21)23)9-11-22(12-10-20)14-17-8-5-13-24-17/h2-8,13,18H,9-12,14-15H2,1H3
InChIKeyIIGPUBGFLMPJLK-UHFFFAOYSA-N
XLogP3.12
TPSA36.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.42
LogP ≤ 53.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(4S)-2-methyl-8-[(5-methylfuran-2-yl)methyl]-4-phenyl-2,8-diazaspiro[4.5]decan-1-one
CID 97415618
(1R)-7-(furan-2-ylmethyl)-2-methyl-1-phenyl-2,7-diazaspiro[3.5]nonan-3-one
CID 97415566
8-(furan-2-ylmethyl)-1-methyl-4-phenyl-1,8-diazaspiro[4.5]decan-2-one
CID 131639615
(3aR,7aS)-6-(furan-2-ylmethyl)-1-methyl-3a-phenyl-2,3,4,5,7,7a-hexahydropyrrolo[2,3-c]pyridine
CID 124813445
(3aR,7aR)-6-(furan-2-ylmethyl)-1-methylsulfonyl-3a-phenyl-2,3,4,5,7,7a-hexahydropyrrolo[2,3-c]pyridine
CID 97381136
4-(dimethylamino)-1-(furan-2-ylmethyl)piperidine-4-carboxylic acid
CID 117011999
(1S)-2-methyl-7-[(5-methylfuran-2-yl)methyl]-1-phenyl-2,7-diazaspiro[3.5]nonan-3-one
CID 97415576
[4-amino-1-(furan-2-ylmethyl)piperidin-4-yl]methanol
CID 117012092
1'-(furan-2-ylmethyl)-1-(2-methoxyethyl)spiro[indole-3,4'-piperidine]-2-one
CID 97375643
4-ethyl-9-(furan-2-ylmethyl)-1-methyl-1,4,9-triazaspiro[5.5]undecan-5-one;bis(2,2,2-trifluoroacetic acid)
CID 155825272
1-benzyl-1'-(furan-2-ylmethyl)spiro[indole-3,4'-piperidine]-2-one
CID 97375659
(2S)-N,8-bis(furan-2-ylmethyl)-1-oxa-8-azaspiro[4.5]decane-2-carboxamide
CID 97422219

Frequently Asked Questions

What is the IUPAC name of 8-(furan-2-ylmethyl)-2-methyl-4-phenyl-2,8-diazaspiro[4.5]decan-1-one?
The IUPAC name of 8-(furan-2-ylmethyl)-2-methyl-4-phenyl-2,8-diazaspiro[4.5]decan-1-one (CID 131662088) is 8-(furan-2-ylmethyl)-2-methyl-4-phenyl-2,8-diazaspiro[4.5]decan-1-one.
What is the SMILES notation for 8-(furan-2-ylmethyl)-2-methyl-4-phenyl-2,8-diazaspiro[4.5]decan-1-one?
The canonical SMILES for 8-(furan-2-ylmethyl)-2-methyl-4-phenyl-2,8-diazaspiro[4.5]decan-1-one is CN1CC(c2ccccc2)C2(CCN(Cc3ccco3)CC2)C1=O.
What is the InChIKey of 8-(furan-2-ylmethyl)-2-methyl-4-phenyl-2,8-diazaspiro[4.5]decan-1-one?
The InChIKey is IIGPUBGFLMPJLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O2/c1-21-15-18(16-6-3-2-4-7-16)20(19(21)23)9-11-22(12-10-20)14-17-8-5-13-24-17/h2-8,13,18H,9-12,14-15H2,1H3.
What are the key properties of 8-(furan-2-ylmethyl)-2-methyl-4-phenyl-2,8-diazaspiro[4.5]decan-1-one?
8-(furan-2-ylmethyl)-2-methyl-4-phenyl-2,8-diazaspiro[4.5]decan-1-one has a molecular weight of 324.42 g/mol, XLogP of 3.12, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(furan-2-ylmethyl)-2-methyl-4-phenyl-2,8-diazaspiro[4.5]decan-1-one is sourced from PubChem (CID 131662088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).