N-[(1R,2R)-2-methoxyspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]-2-phenylacetamide

C22H26N2O2 — CID 70740066

IUPACN-[(1R,2R)-2-methoxyspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]-2-phenylacetamide
SMILESCO[C@H]1[C@H](NC(=O)Cc2ccccc2)c2ccccc2C12CCNCC2
InChIInChI=1S/C22H26N2O2/c1-26-21-20(24-19(25)15-16-7-3-2-4-8-16)17-9-5-6-10-18(17)22(21)11-13-23-14-12-22/h2-10,20-21,23H,11-15H2,1H3,(H,24,25)/t20-,21+/m1/s1
InChIKeyGSBUBGSQXFJQHY-RTWAWAEBSA-N
MW350.46 g/mol
LogP2.74
Rot. Bonds4

About N-[(1R,2R)-2-methoxyspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]-2-phenylacetamide

N-[(1R,2R)-2-methoxyspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]-2-phenylacetamide (PubChem CID 70740066) has the molecular formula C22H26N2O2 and a molecular weight of 350.46 g/mol. Its IUPAC name is N-[(1R,2R)-2-methoxyspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]-2-phenylacetamide.

Molecular Properties

Compound NameN-[(1R,2R)-2-methoxyspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]-2-phenylacetamide
PubChem CID70740066
Molecular FormulaC22H26N2O2
Molecular Weight350.46 g/mol
Exact Mass350.20
IUPAC NameN-[(1R,2R)-2-methoxyspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]-2-phenylacetamide
SMILESCO[C@H]1[C@H](NC(=O)Cc2ccccc2)c2ccccc2C12CCNCC2
InChIInChI=1S/C22H26N2O2/c1-26-21-20(24-19(25)15-16-7-3-2-4-8-16)17-9-5-6-10-18(17)22(21)11-13-23-14-12-22/h2-10,20-21,23H,11-15H2,1H3,(H,24,25)/t20-,21+/m1/s1
InChIKeyGSBUBGSQXFJQHY-RTWAWAEBSA-N
XLogP2.74
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.46
LogP ≤ 52.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(1R,2R)-2-methoxyspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]-2-phenylacetamide?
The IUPAC name of N-[(1R,2R)-2-methoxyspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]-2-phenylacetamide (CID 70740066) is N-[(1R,2R)-2-methoxyspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]-2-phenylacetamide.
What is the SMILES notation for N-[(1R,2R)-2-methoxyspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]-2-phenylacetamide?
The canonical SMILES for N-[(1R,2R)-2-methoxyspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]-2-phenylacetamide is CO[C@H]1[C@H](NC(=O)Cc2ccccc2)c2ccccc2C12CCNCC2.
What is the InChIKey of N-[(1R,2R)-2-methoxyspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]-2-phenylacetamide?
The InChIKey is GSBUBGSQXFJQHY-RTWAWAEBSA-N. The full InChI is InChI=1S/C22H26N2O2/c1-26-21-20(24-19(25)15-16-7-3-2-4-8-16)17-9-5-6-10-18(17)22(21)11-13-23-14-12-22/h2-10,20-21,23H,11-15H2,1H3,(H,24,25)/t20-,21+/m1/s1.
What are the key properties of N-[(1R,2R)-2-methoxyspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]-2-phenylacetamide?
N-[(1R,2R)-2-methoxyspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]-2-phenylacetamide has a molecular weight of 350.46 g/mol, XLogP of 2.74, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R,2R)-2-methoxyspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]-2-phenylacetamide is sourced from PubChem (CID 70740066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).