2-[5-fluoro-1'-(2-methoxyethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide

C18H25FN2O2 — CID 118739125

IUPAC2-[5-fluoro-1'-(2-methoxyethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide
SMILESCOCCN1CCC2(CC1)CC(CC(N)=O)c1ccc(F)cc12
InChIInChI=1S/C18H25FN2O2/c1-23-9-8-21-6-4-18(5-7-21)12-13(10-17(20)22)15-3-2-14(19)11-16(15)18/h2-3,11,13H,4-10,12H2,1H3,(H2,20,22)
InChIKeyZOQFXLDHDCMENO-UHFFFAOYSA-N
MW320.41 g/mol
LogP2.17
Rot. Bonds5

About 2-[5-fluoro-1'-(2-methoxyethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide

2-[5-fluoro-1'-(2-methoxyethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide (PubChem CID 118739125) has the molecular formula C18H25FN2O2 and a molecular weight of 320.41 g/mol. Its IUPAC name is 2-[5-fluoro-1'-(2-methoxyethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide.

Molecular Properties

Compound Name2-[5-fluoro-1'-(2-methoxyethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide
PubChem CID118739125
Molecular FormulaC18H25FN2O2
Molecular Weight320.41 g/mol
Exact Mass320.19
IUPAC Name2-[5-fluoro-1'-(2-methoxyethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide
SMILESCOCCN1CCC2(CC1)CC(CC(N)=O)c1ccc(F)cc12
InChIInChI=1S/C18H25FN2O2/c1-23-9-8-21-6-4-18(5-7-21)12-13(10-17(20)22)15-3-2-14(19)11-16(15)18/h2-3,11,13H,4-10,12H2,1H3,(H2,20,22)
InChIKeyZOQFXLDHDCMENO-UHFFFAOYSA-N
XLogP2.17
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.41
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(4-fluorophenyl)-2,2-dimethyl-N-(3-morpholin-4-ylpropyl)cyclopropane-1-carboxamide
CID 145969076
Methanone, (2-indanyl)(4-morpholyl)-
CID 576078
Butyramide, 2-ethyl-4-morpholino-2-phenyl-
CID 18114
Butyramide, 2-isopropyl-4-morpholino-2-phenyl-
CID 46435
Valeramide, 3-methyl-2-(2-morpholinoethyl)-2-phenyl-
CID 102939
3-(4-fluorophenyl)-N-(3-morpholin-4-yl-3-oxopropyl)butanamide
CID 51089591
1-(4-fluorophenyl)-N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]cyclobutane-1-carboxamide
CID 71880040
1-(5-Fluorospiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl)-2-methoxyethanone
CID 97449372
2-(1'-acetyl-5-fluorospiro[1,2-dihydroindene-3,4'-piperidine]-1-yl)-N-ethylacetamide
CID 118739127
2-(5-Fluoro-1'-propanoylspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl)acetamide
CID 118739129
2-(1'-ethyl-5-fluorospiro[1,2-dihydroindene-3,4'-piperidine]-1-yl)-N,N-dimethylacetamide
CID 118740882
2-(5-fluoro-1'-propanoylspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl)-N,N-dimethylacetamide
CID 118740890

Frequently Asked Questions

What is the IUPAC name of 2-[5-fluoro-1'-(2-methoxyethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide?
The IUPAC name of 2-[5-fluoro-1'-(2-methoxyethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide (CID 118739125) is 2-[5-fluoro-1'-(2-methoxyethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide.
What is the SMILES notation for 2-[5-fluoro-1'-(2-methoxyethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide?
The canonical SMILES for 2-[5-fluoro-1'-(2-methoxyethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide is COCCN1CCC2(CC1)CC(CC(N)=O)c1ccc(F)cc12.
What is the InChIKey of 2-[5-fluoro-1'-(2-methoxyethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide?
The InChIKey is ZOQFXLDHDCMENO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25FN2O2/c1-23-9-8-21-6-4-18(5-7-21)12-13(10-17(20)22)15-3-2-14(19)11-16(15)18/h2-3,11,13H,4-10,12H2,1H3,(H2,20,22).
What are the key properties of 2-[5-fluoro-1'-(2-methoxyethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide?
2-[5-fluoro-1'-(2-methoxyethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide has a molecular weight of 320.41 g/mol, XLogP of 2.17, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-fluoro-1'-(2-methoxyethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide is sourced from PubChem (CID 118739125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).