Chemical ID: 4267739

c1ccc(c(c1)C(CC(=O)N2CCCCC2)N3CCCCC3)O
Chemical ID:
4267739
Name [?]:
3-(2-hydroxyphenyl)-1,3-bis(1-piperidyl)propan-1-one
SMILES [?]:
c1ccc(c(c1)C(CC(=O)N2CCCCC2)N3CCCCC3)O
InChi [?]:
InChI=1/C19H28N2O2/c22-18-10-4-3-9-16(18)17(20-11-5-1-6-12-20)15-19(23)21-13-7-2-8-14-21/h3-4,9-10,17,22H,1-2,5-8,11-15H2
InChi Info:
AuxInfo=1/0/N:20,14,1,2,19,21,13,15,6,3,18,22,12,16,8,5,7,4,9,17,11,23,10/E:(5,6)(7,8)(11,12)(13,14)/rA:23cCCCCCCCCCONCCCCCNCCCCCO/rB:s1;d2;s3;d4;d1s5;s5;s7;s8;d9;s9;s11;s12;s13;s14;s11s15;s7;s17;s18;s19;s20;s17s21;s4;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H28N2O2
All Atoms:23
Heavy Atoms:23
Chiral Atoms:1
ZAP Information [?]
Total:9.43982
Area:503.47
Solvation:-3.14694
Coulombic:-37.2095
Bond Count [?]
All:25
Single:21
Double:4
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:316.438
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:2.67
LogP (Chemaxon):2.36

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