CID 44770664
PubChem CID
44770664
Structure
Molecular Formula
Status
Non-live
Molecular Weight
377.5 g/mol
Dates
- Create:2010-03-14
Chemical Structure Depiction
6,7-dimethyl-1'-[(4-propan-2-ylphenyl)methyl]spiro[3H-chromene-2,4'-piperidine]-4-one
InChI=1S/C25H31NO2/c1-17(2)21-7-5-20(6-8-21)16-26-11-9-25(10-12-26)15-23(27)22-13-18(3)19(4)14-24(22)28-25/h5-8,13-14,17H,9-12,15-16H2,1-4H3
ULXYCECCKSLURJ-UHFFFAOYSA-N
CC1=CC2=C(C=C1C)OC3(CCN(CC3)CC4=CC=C(C=C4)C(C)C)CC2=O
C25H31NO2
Property Name
Property Value
Reference
Property Name
Molecular Weight
Property Value
377.5 g/mol
Property Name
XLogP3-AA
Property Value
5.1
Property Name
Hydrogen Bond Donor Count
Property Value
0
Property Name
Hydrogen Bond Acceptor Count
Property Value
3
Property Name
Rotatable Bond Count
Property Value
3
Property Name
Exact Mass
Property Value
377.235479232 g/mol
Property Name
Monoisotopic Mass
Property Value
377.235479232 g/mol
Property Name
Topological Polar Surface Area
Property Value
29.5 A^2
Property Name
Heavy Atom Count
Property Value
28
Property Name
Formal Charge
Property Value
0
Property Name
Complexity
Property Value
543
Property Name
Isotope Atom Count
Property Value
0
Property Name
Defined Atom Stereocenter Count
Property Value
0
Property Name
Undefined Atom Stereocenter Count
Property Value
0
Property Name
Defined Bond Stereocenter Count
Property Value
0
Property Name
Undefined Bond Stereocenter Count
Property Value
0
Property Name
Covalently-Bonded Unit Count
Property Value
1
Property Name
Compound Is Canonicalized
Property Value
Yes
Old substance
CONTENTS