General Information of the Compound
Compound ID
CP0273794
Compound Name
2-[4-(3-Piperidin-1-yl-propoxy)-phenyl]-indolizine
    Show/Hide
Structure
Formula
C22H26N2O
Molecular Weight
334.463
Canonical SMILES
C(COc1ccc(cc1)-c1cc2ccccn2c1)CN1CCCCC1
    Show/Hide
InChI
InChI=1S/C22H26N2O/c1-3-12-23(13-4-1)14-6-16-25-22-10-8-19(9-11-22)20-17-21-7-2-5-15-24(21)18-20/h2,5,7-11,15,17-18H,1,3-4,6,12-14,16H2
    Show/Hide
InChIKey
KDEPDSHXUKZUKL-UHFFFAOYSA-N
Physicochemical Property
logP
4.8611
Rotatable Bonds
6
Heavy Atom Count
25
Polar Areas
16.88
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
3
Complexity
25

"RO5" indicates the cutoff set by lipinski's rule of five:

(1) Molecular weight less than 500 Dalton;

(2) xlogp less than 5;

(3) No more than 5 hbonddonor (Hydrogen Bond Donor Count);

(4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count);

(5) No more than 10 rotbonds (Rotatable Bond Count).

    Show/Hide
Click to Show/Hide the External Link(s) of This Compound
PubChem ID
CID: 9923762
SID: 14895492
ChEMBL ID
CHEMBL52160