Chemical ID: 4587610

c1ccc(cc1)C(CCN2CCCCC2)O
Chemical ID:
4587610
Name [?]:
1-phenyl-3-(1-piperidyl)propan-1-ol
SMILES [?]:
c1ccc(cc1)C(CCN2CCCCC2)O
InChi [?]:
InChI=1/C14H21NO/c16-14(13-7-3-1-4-8-13)9-12-15-10-5-2-6-11-15/h1,3-4,7-8,14,16H,2,5-6,9-12H2
InChi Info:
AuxInfo=1/0/N:1,13,2,6,12,14,3,5,8,11,15,9,4,7,10,16/E:(3,4)(5,6)(7,8)(10,11)/rA:16cCCCCCCCCCNCCCCCO/rB:s1;d2;s3;d4;d1s5;s4;s7;s8;s9;s10;s11;s12;s13;s10s14;s7;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H21NO
All Atoms:16
Heavy Atoms:16
Chiral Atoms:1
ZAP Information [?]
Total:8.39453
Area:421.016
Solvation:-2.13086
Coulombic:-23.8848
Bond Count [?]
All:17
Single:14
Double:3
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:219.323
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:2.39
LogP (Chemaxon):2.33

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue