Chemical ID: 5011691

c1ccc2c(c1)cccc2CC3CCCCN3
Chemical ID:
5011691
Name [?]:
2-(1-naphthylmethyl)piperidine
SMILES [?]:
c1ccc2c(c1)cccc2CC3CCCCN3
InChi [?]:
InChI=1/C16H19N/c1-2-10-16-13(6-1)7-5-8-14(16)12-15-9-3-4-11-17-15/h1-2,5-8,10,15,17H,3-4,9,11-12H2
InChi Info:
AuxInfo=1/0/N:1,2,14,15,8,6,7,9,13,3,16,11,5,10,12,4,17/rA:17cCCCCCCCCCCCCCCCCN/rB:s1;d2;s3;s4;d1s5;d5;s7;d8;d4s9;s10;s11;s12;s13;s14;s15;s12s16;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H19N
All Atoms:17
Heavy Atoms:17
Chiral Atoms:1
ZAP Information [?]
Total:9.01234
Area:406.014
Solvation:-1.13802
Coulombic:-11.7143
Bond Count [?]
All:19
Single:14
Double:5
Rotors:2
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:225.329
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:3.86
LogP (Chemaxon):3.62

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