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Chemical ID: 4949908
Chemical ID:
4949908
Name [?]:
2-cyclohexyl-N-(2-cyclohexylethyl)-N-methyl-ethanamine
SMILES [?]:
CN(CCC1CCCCC1)CCC2CCCCC2
InChi [?]:
InChI=1/C17H33N/c1-18(14-12-16-8-4-2-5-9-16)15-13-17-10-6-3-7-11-17/h16-17H,2-15H2,1H3
InChi Info:
AuxInfo=1/0/N:1,8,16,7,9,15,17,6,10,14,18,4,12,3,11,5,13,2/E:(2,3)(4,5,6,7)(8,9,10,11)(12,13)(14,15)(16,17)/rA:18nCNCCCCCCCCCCCCCCCC/rB:s1;s2;s3;s4;s5;s6;s7;s8;s5s9;s2;s11;s12;s13;s14;s15;s16;s13s17;/rC:;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C17H33N |
All Atoms: | 18 |
Heavy Atoms: | 18 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 11.3751 |
Area: | 483.068 |
Solvation: | -0.701575 |
Coulombic: | -8.18104 |
Bond Count [?]
All: | 19 |
Single: | 19 |
Double: | 0 |
Rotors: | 6 |
Chiral: | 0 |
Rigid Segments: | 5 |
Chemical Properties
Molecular Weight: | 251.451 |
H-Bond Donors: | 0 |
H-Bond Acceptors: | 1 |
XLogP: | 5.46 |
LogP (Chemaxon): | 4.6 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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