Chemical ID: 5153035

CC(C1CCN(CC1)Cc2ccccc2)O
Chemical ID:
5153035
Name [?]:
1-(1-benzyl-4-piperidyl)ethanol
SMILES [?]:
CC(C1CCN(CC1)Cc2ccccc2)O
InChi [?]:
InChI=1/C14H21NO/c1-12(16)14-7-9-15(10-8-14)11-13-5-3-2-4-6-13/h2-6,12,14,16H,7-11H2,1H3
InChi Info:
AuxInfo=1/0/N:1,13,12,14,11,15,4,8,5,7,9,2,10,3,6,16/E:(3,4)(5,6)(7,8)(9,10)/rA:16cCCCCCNCCCCCCCCCO/rB:s1;s2;s3;s4;s5;s6;s3s7;s6;s9;s10;d11;s12;d13;d10s14;s2;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H21NO
All Atoms:16
Heavy Atoms:16
Chiral Atoms:1
ZAP Information [?]
Total:7.77075
Area:408.679
Solvation:-2.44623
Coulombic:-23.3289
Bond Count [?]
All:17
Single:14
Double:3
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:219.323
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:2.26
LogP (Chemaxon):2.32

Name Annotations

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Descriptor Annotations

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