Chemical ID: 5177620

CCNC1C2CCC(C2)C1c3ccccc3
Chemical ID:
5177620
Name [?]:
N-ethyl-3-phenyl-norbornan-2-amine
SMILES [?]:
CCNC1C2CCC(C2)C1c3ccccc3
InChi [?]:
InChI=1/C15H21N/c1-2-16-15-13-9-8-12(10-13)14(15)11-6-4-3-5-7-11/h3-7,12-16H,2,8-10H2,1H3
InChi Info:
AuxInfo=1/0/N:1,2,14,13,15,12,16,7,6,9,11,8,5,10,4,3/E:(4,5)(6,7)/rA:16cCCNCCCCCCCCCCCCC/rB:s1;s2;s3;s4;s5;s6;s7;s5s8;s4s8;s10;s11;d12;s13;d14;d11s15;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H21N
All Atoms:16
Heavy Atoms:16
Chiral Atoms:4
ZAP Information [?]
Total:8.82876
Area:381.414
Solvation:-0.706601
Coulombic:-11.7559
Bond Count [?]
All:18
Single:15
Double:3
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:215.334
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:3.35
LogP (Chemaxon):3.18

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