N-[(1S)-1'-(1,3-dimethylpiperidin-4-yl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide

C22H33N3O — CID 59432992

IUPACN-[(1S)-1'-(1,3-dimethylpiperidin-4-yl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide
SMILESCC(=O)N[C@H]1CC2(CCN(C3CCN(C)CC3C)CC2)c2ccccc21
InChIInChI=1S/C22H33N3O/c1-16-15-24(3)11-8-21(16)25-12-9-22(10-13-25)14-20(23-17(2)26)18-6-4-5-7-19(18)22/h4-7,16,20-21H,8-15H2,1-3H3,(H,23,26)/t16?,20-,21?/m0/s1
InChIKeyGUAZRYWUTFCZCT-WJAMPBCPSA-N
MW355.53 g/mol
LogP2.94
Rot. Bonds2

About N-[(1S)-1'-(1,3-dimethylpiperidin-4-yl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide

N-[(1S)-1'-(1,3-dimethylpiperidin-4-yl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide (PubChem CID 59432992) has the molecular formula C22H33N3O and a molecular weight of 355.53 g/mol. Its IUPAC name is N-[(1S)-1'-(1,3-dimethylpiperidin-4-yl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide.

Molecular Properties

Compound NameN-[(1S)-1'-(1,3-dimethylpiperidin-4-yl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide
PubChem CID59432992
Molecular FormulaC22H33N3O
Molecular Weight355.53 g/mol
Exact Mass355.26
IUPAC NameN-[(1S)-1'-(1,3-dimethylpiperidin-4-yl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide
SMILESCC(=O)N[C@H]1CC2(CCN(C3CCN(C)CC3C)CC2)c2ccccc21
InChIInChI=1S/C22H33N3O/c1-16-15-24(3)11-8-21(16)25-12-9-22(10-13-25)14-20(23-17(2)26)18-6-4-5-7-19(18)22/h4-7,16,20-21H,8-15H2,1-3H3,(H,23,26)/t16?,20-,21?/m0/s1
InChIKeyGUAZRYWUTFCZCT-WJAMPBCPSA-N
XLogP2.94
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.53
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[(1S)-1'-(1,3-dimethylpiperidin-4-yl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[(1S)-1'-(1,3-dimethylpiperidin-4-yl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide?
The IUPAC name of N-[(1S)-1'-(1,3-dimethylpiperidin-4-yl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide (CID 59432992) is N-[(1S)-1'-(1,3-dimethylpiperidin-4-yl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide.
What is the SMILES notation for N-[(1S)-1'-(1,3-dimethylpiperidin-4-yl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide?
The canonical SMILES for N-[(1S)-1'-(1,3-dimethylpiperidin-4-yl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide is CC(=O)N[C@H]1CC2(CCN(C3CCN(C)CC3C)CC2)c2ccccc21.
What is the InChIKey of N-[(1S)-1'-(1,3-dimethylpiperidin-4-yl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide?
The InChIKey is GUAZRYWUTFCZCT-WJAMPBCPSA-N. The full InChI is InChI=1S/C22H33N3O/c1-16-15-24(3)11-8-21(16)25-12-9-22(10-13-25)14-20(23-17(2)26)18-6-4-5-7-19(18)22/h4-7,16,20-21H,8-15H2,1-3H3,(H,23,26)/t16?,20-,21?/m0/s1.
What are the key properties of N-[(1S)-1'-(1,3-dimethylpiperidin-4-yl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide?
N-[(1S)-1'-(1,3-dimethylpiperidin-4-yl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide has a molecular weight of 355.53 g/mol, XLogP of 2.94, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S)-1'-(1,3-dimethylpiperidin-4-yl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide is sourced from PubChem (CID 59432992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).