1'-(furan-2-carbonyl)-1-(2-methoxyethyl)spiro[indole-3,4'-piperidine]-2-one

C20H22N2O4 — CID 97375649

IUPAC1'-(furan-2-carbonyl)-1-(2-methoxyethyl)spiro[indole-3,4'-piperidine]-2-one
SMILESCOCCN1C(=O)C2(CCN(C(=O)c3ccco3)CC2)c2ccccc21
InChIInChI=1S/C20H22N2O4/c1-25-14-12-22-16-6-3-2-5-15(16)20(19(22)24)8-10-21(11-9-20)18(23)17-7-4-13-26-17/h2-7,13H,8-12,14H2,1H3
InChIKeyUOCXDIBGBNYQHC-UHFFFAOYSA-N
MW354.41 g/mol
LogP2.45
Rot. Bonds4

About 1'-(furan-2-carbonyl)-1-(2-methoxyethyl)spiro[indole-3,4'-piperidine]-2-one

1'-(furan-2-carbonyl)-1-(2-methoxyethyl)spiro[indole-3,4'-piperidine]-2-one (PubChem CID 97375649) has the molecular formula C20H22N2O4 and a molecular weight of 354.41 g/mol. Its IUPAC name is 1'-(furan-2-carbonyl)-1-(2-methoxyethyl)spiro[indole-3,4'-piperidine]-2-one.

Molecular Properties

Compound Name1'-(furan-2-carbonyl)-1-(2-methoxyethyl)spiro[indole-3,4'-piperidine]-2-one
PubChem CID97375649
Molecular FormulaC20H22N2O4
Molecular Weight354.41 g/mol
Exact Mass354.16
IUPAC Name1'-(furan-2-carbonyl)-1-(2-methoxyethyl)spiro[indole-3,4'-piperidine]-2-one
SMILESCOCCN1C(=O)C2(CCN(C(=O)c3ccco3)CC2)c2ccccc21
InChIInChI=1S/C20H22N2O4/c1-25-14-12-22-16-6-3-2-5-15(16)20(19(22)24)8-10-21(11-9-20)18(23)17-7-4-13-26-17/h2-7,13H,8-12,14H2,1H3
InChIKeyUOCXDIBGBNYQHC-UHFFFAOYSA-N
XLogP2.45
TPSA62.99 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.41
LogP ≤ 52.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1'-(furan-2-ylmethyl)-1-(2-methoxyethyl)spiro[indole-3,4'-piperidine]-2-one
CID 97375643
9-(furan-2-carbonyl)-2-(2-methoxyethyl)-2,9-diazaspiro[5.5]undecan-1-one
CID 98896391
1'-(furan-3-ylmethyl)-1-(2-methoxyethyl)spiro[indole-3,4'-piperidine]-2-one
CID 124544221
(5S)-9-(furan-2-carbonyl)-2-(2-methoxyethyl)-2,9-diazaspiro[4.6]undecan-1-one
CID 98896591
furan-2-yl-[4-(2-methoxyethyl)piperazin-1-yl]methanone
CID 113073228
(3S)-8-(furan-2-carbonyl)-1-(2-methoxyethyl)-3-phenyl-1,8-diazaspiro[4.5]decan-2-one
CID 97383988
1'-[(4-fluorophenyl)methyl]-1-(2-methoxyethyl)spiro[indole-3,4'-piperidine]-2-one
CID 97375647
methyl 2-oxo-1-(2-phenylethyl)spiro[indole-3,3'-pyrrolidine]-1'-carboxylate
CID 134795039
1-(2-methoxyethyl)-1'-[6-(1,2,4-triazol-4-yl)pyridine-2-carbonyl]spiro[indole-3,3'-pyrrolidine]-2-one
CID 157018402
1'-(3-methoxypropanoyl)-1-methylspiro[indole-3,4'-piperidine]-2-one
CID 91914352
8-(furan-2-carbonyl)-3-(2-phenylethyl)-1,3,8-triazaspiro[4.5]decane-2,4-dione
CID 42109531
furan-2-yl-[4-(2-methoxyethyl)piperidin-1-yl]methanone
CID 53150870

Frequently Asked Questions

What is the IUPAC name of 1'-(furan-2-carbonyl)-1-(2-methoxyethyl)spiro[indole-3,4'-piperidine]-2-one?
The IUPAC name of 1'-(furan-2-carbonyl)-1-(2-methoxyethyl)spiro[indole-3,4'-piperidine]-2-one (CID 97375649) is 1'-(furan-2-carbonyl)-1-(2-methoxyethyl)spiro[indole-3,4'-piperidine]-2-one.
What is the SMILES notation for 1'-(furan-2-carbonyl)-1-(2-methoxyethyl)spiro[indole-3,4'-piperidine]-2-one?
The canonical SMILES for 1'-(furan-2-carbonyl)-1-(2-methoxyethyl)spiro[indole-3,4'-piperidine]-2-one is COCCN1C(=O)C2(CCN(C(=O)c3ccco3)CC2)c2ccccc21.
What is the InChIKey of 1'-(furan-2-carbonyl)-1-(2-methoxyethyl)spiro[indole-3,4'-piperidine]-2-one?
The InChIKey is UOCXDIBGBNYQHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O4/c1-25-14-12-22-16-6-3-2-5-15(16)20(19(22)24)8-10-21(11-9-20)18(23)17-7-4-13-26-17/h2-7,13H,8-12,14H2,1H3.
What are the key properties of 1'-(furan-2-carbonyl)-1-(2-methoxyethyl)spiro[indole-3,4'-piperidine]-2-one?
1'-(furan-2-carbonyl)-1-(2-methoxyethyl)spiro[indole-3,4'-piperidine]-2-one has a molecular weight of 354.41 g/mol, XLogP of 2.45, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1'-(furan-2-carbonyl)-1-(2-methoxyethyl)spiro[indole-3,4'-piperidine]-2-one is sourced from PubChem (CID 97375649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).