2-phenyl-N-(3-spiro[1,2-dihydroindene-3,4'-piperidine]-1'-ylpropyl)cyclopropane-1-carboxamide

C26H32N2O — CID 11523929

IUPAC2-phenyl-N-(3-spiro[1,2-dihydroindene-3,4'-piperidine]-1'-ylpropyl)cyclopropane-1-carboxamide
SMILESO=C(NCCCN1CCC2(CCc3ccccc32)CC1)C1CC1c1ccccc1
InChIInChI=1S/C26H32N2O/c29-25(23-19-22(23)20-7-2-1-3-8-20)27-15-6-16-28-17-13-26(14-18-28)12-11-21-9-4-5-10-24(21)26/h1-5,7-10,22-23H,6,11-19H2,(H,27,29)
InChIKeyKEBJTPRYSCTYBB-UHFFFAOYSA-N
MW388.56 g/mol
LogP4.28
Rot. Bonds6

About 2-phenyl-N-(3-spiro[1,2-dihydroindene-3,4'-piperidine]-1'-ylpropyl)cyclopropane-1-carboxamide

2-phenyl-N-(3-spiro[1,2-dihydroindene-3,4'-piperidine]-1'-ylpropyl)cyclopropane-1-carboxamide (PubChem CID 11523929) has the molecular formula C26H32N2O and a molecular weight of 388.56 g/mol. Its IUPAC name is 2-phenyl-N-(3-spiro[1,2-dihydroindene-3,4'-piperidine]-1'-ylpropyl)cyclopropane-1-carboxamide.

Molecular Properties

Compound Name2-phenyl-N-(3-spiro[1,2-dihydroindene-3,4'-piperidine]-1'-ylpropyl)cyclopropane-1-carboxamide
PubChem CID11523929
Molecular FormulaC26H32N2O
Molecular Weight388.56 g/mol
Exact Mass388.25
IUPAC Name2-phenyl-N-(3-spiro[1,2-dihydroindene-3,4'-piperidine]-1'-ylpropyl)cyclopropane-1-carboxamide
SMILESO=C(NCCCN1CCC2(CCc3ccccc32)CC1)C1CC1c1ccccc1
InChIInChI=1S/C26H32N2O/c29-25(23-19-22(23)20-7-2-1-3-8-20)27-15-6-16-28-17-13-26(14-18-28)12-11-21-9-4-5-10-24(21)26/h1-5,7-10,22-23H,6,11-19H2,(H,27,29)
InChIKeyKEBJTPRYSCTYBB-UHFFFAOYSA-N
XLogP4.28
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.56
LogP ≤ 54.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-phenyl-N-(3-spiro[1,2-dihydroindene-3,4'-piperidine]-1'-ylpropyl)cyclopropane-1-carboxamide?
The IUPAC name of 2-phenyl-N-(3-spiro[1,2-dihydroindene-3,4'-piperidine]-1'-ylpropyl)cyclopropane-1-carboxamide (CID 11523929) is 2-phenyl-N-(3-spiro[1,2-dihydroindene-3,4'-piperidine]-1'-ylpropyl)cyclopropane-1-carboxamide.
What is the SMILES notation for 2-phenyl-N-(3-spiro[1,2-dihydroindene-3,4'-piperidine]-1'-ylpropyl)cyclopropane-1-carboxamide?
The canonical SMILES for 2-phenyl-N-(3-spiro[1,2-dihydroindene-3,4'-piperidine]-1'-ylpropyl)cyclopropane-1-carboxamide is O=C(NCCCN1CCC2(CCc3ccccc32)CC1)C1CC1c1ccccc1.
What is the InChIKey of 2-phenyl-N-(3-spiro[1,2-dihydroindene-3,4'-piperidine]-1'-ylpropyl)cyclopropane-1-carboxamide?
The InChIKey is KEBJTPRYSCTYBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H32N2O/c29-25(23-19-22(23)20-7-2-1-3-8-20)27-15-6-16-28-17-13-26(14-18-28)12-11-21-9-4-5-10-24(21)26/h1-5,7-10,22-23H,6,11-19H2,(H,27,29).
What are the key properties of 2-phenyl-N-(3-spiro[1,2-dihydroindene-3,4'-piperidine]-1'-ylpropyl)cyclopropane-1-carboxamide?
2-phenyl-N-(3-spiro[1,2-dihydroindene-3,4'-piperidine]-1'-ylpropyl)cyclopropane-1-carboxamide has a molecular weight of 388.56 g/mol, XLogP of 4.28, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-N-(3-spiro[1,2-dihydroindene-3,4'-piperidine]-1'-ylpropyl)cyclopropane-1-carboxamide is sourced from PubChem (CID 11523929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).