CID 39384943
PubChem CID
39384943
Structure
Molecular Formula
Status
Non-live
Molecular Weight
284.4 g/mol
Dates
- Create:2009-05-29
Chemical Structure Depiction
(2R)-2-(4-propan-2-ylphenyl)-1-(pyridin-2-ylmethylamino)propan-2-ol
InChI=1S/C18H24N2O/c1-14(2)15-7-9-16(10-8-15)18(3,21)13-19-12-17-6-4-5-11-20-17/h4-11,14,19,21H,12-13H2,1-3H3/t18-/m0/s1
GTAASULPEVAMAZ-SFHVURJKSA-N
CC(C)C1=CC=C(C=C1)[C@](C)(CNCC2=CC=CC=N2)O
C18H24N2O
Property Name
Property Value
Reference
Property Name
Molecular Weight
Property Value
284.4 g/mol
Property Name
XLogP3-AA
Property Value
2.4
Property Name
Hydrogen Bond Donor Count
Property Value
2
Property Name
Hydrogen Bond Acceptor Count
Property Value
3
Property Name
Rotatable Bond Count
Property Value
6
Property Name
Exact Mass
Property Value
284.188863393 g/mol
Property Name
Monoisotopic Mass
Property Value
284.188863393 g/mol
Property Name
Topological Polar Surface Area
Property Value
45.2 A^2
Property Name
Heavy Atom Count
Property Value
21
Property Name
Formal Charge
Property Value
0
Property Name
Complexity
Property Value
300
Property Name
Isotope Atom Count
Property Value
0
Property Name
Defined Atom Stereocenter Count
Property Value
1
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
Old substance
CONTENTS