Chemical ID: 4625413

CC(Cc1ccccc1)NC2CN3CCC2CC3
Chemical ID:
4625413
Name [?]:
N-(1-methyl-2-phenyl-ethyl)quinuclidin-3-amine
SMILES [?]:
CC(Cc1ccccc1)NC2CN3CCC2CC3
InChi [?]:
InChI=1/C16H24N2/c1-13(11-14-5-3-2-4-6-14)17-16-12-18-9-7-15(16)8-10-18/h2-6,13,15-17H,7-12H2,1H3
InChi Info:
AuxInfo=1/0/N:1,7,6,8,5,9,15,17,14,18,3,12,2,4,16,11,10,13/E:(3,4)(5,6)(7,8)(9,10)/rA:18cCCCCCCCCCNCCNCCCCC/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s2;s10;s11;s12;s13;s14;s11s15;s16;s13s17;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H24N2
All Atoms:18
Heavy Atoms:18
Chiral Atoms:2
ZAP Information [?]
Total:9.09711
Area:419.115
Solvation:-1.38077
Coulombic:-15.4786
Bond Count [?]
All:20
Single:17
Double:3
Rotors:4
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:244.375
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:2.57
LogP (Chemaxon):2.53

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Descriptor Annotations

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