N-(1'-cycloheptylspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl)acetamide;molecular hydrogen

C22H34N2O — CID 161073343

IUPACN-(1'-cycloheptylspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl)acetamide;molecular hydrogen
SMILESCC(=O)NC1CC2(CCN(C3CCCCCC3)CC2)c2ccccc21.[H][H]
InChIInChI=1S/C22H32N2O.H2/c1-17(25)23-21-16-22(20-11-7-6-10-19(20)21)12-14-24(15-13-22)18-8-4-2-3-5-9-18;/h6-7,10-11,18,21H,2-5,8-9,12-16H2,1H3,(H,23,25);1H
InChIKeyUEYDPXSNAHAAST-UHFFFAOYSA-N
MW342.53 g/mol
LogP4.57
Rot. Bonds2

About N-(1'-cycloheptylspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl)acetamide;molecular hydrogen

N-(1'-cycloheptylspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl)acetamide;molecular hydrogen (PubChem CID 161073343) has the molecular formula C22H34N2O and a molecular weight of 342.53 g/mol. Its IUPAC name is N-(1'-cycloheptylspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl)acetamide;molecular hydrogen.

Molecular Properties

Compound NameN-(1'-cycloheptylspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl)acetamide;molecular hydrogen
PubChem CID161073343
Molecular FormulaC22H34N2O
Molecular Weight342.53 g/mol
Exact Mass342.27
IUPAC NameN-(1'-cycloheptylspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl)acetamide;molecular hydrogen
SMILESCC(=O)NC1CC2(CCN(C3CCCCCC3)CC2)c2ccccc21.[H][H]
InChIInChI=1S/C22H32N2O.H2/c1-17(25)23-21-16-22(20-11-7-6-10-19(20)21)12-14-24(15-13-22)18-8-4-2-3-5-9-18;/h6-7,10-11,18,21H,2-5,8-9,12-16H2,1H3,(H,23,25);1H
InChIKeyUEYDPXSNAHAAST-UHFFFAOYSA-N
XLogP4.57
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.53
LogP ≤ 54.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(1'-cycloheptylspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl)acetamide;molecular hydrogen 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-(1'-cycloheptylspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl)acetamide;molecular hydrogen?
The IUPAC name of N-(1'-cycloheptylspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl)acetamide;molecular hydrogen (CID 161073343) is N-(1'-cycloheptylspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl)acetamide;molecular hydrogen.
What is the SMILES notation for N-(1'-cycloheptylspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl)acetamide;molecular hydrogen?
The canonical SMILES for N-(1'-cycloheptylspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl)acetamide;molecular hydrogen is CC(=O)NC1CC2(CCN(C3CCCCCC3)CC2)c2ccccc21.[H][H].
What is the InChIKey of N-(1'-cycloheptylspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl)acetamide;molecular hydrogen?
The InChIKey is UEYDPXSNAHAAST-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H32N2O.H2/c1-17(25)23-21-16-22(20-11-7-6-10-19(20)21)12-14-24(15-13-22)18-8-4-2-3-5-9-18;/h6-7,10-11,18,21H,2-5,8-9,12-16H2,1H3,(H,23,25);1H.
What are the key properties of N-(1'-cycloheptylspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl)acetamide;molecular hydrogen?
N-(1'-cycloheptylspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl)acetamide;molecular hydrogen has a molecular weight of 342.53 g/mol, XLogP of 4.57, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1'-cycloheptylspiro[1,2-dihydroindene-3,4'-piperidine]-1-yl)acetamide;molecular hydrogen is sourced from PubChem (CID 161073343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).