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Chemical ID: 6510357
Chemical ID:
6510357
Name [?]:
3-azepan-1-yl-2,2-dimethyl-propan-1-amine
SMILES [?]:
CC(C)(CN)CN1CCCCCC1
InChi [?]:
InChI=1/C11H24N2/c1-11(2,9-12)10-13-7-5-3-4-6-8-13/h3-10,12H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,3,10,11,9,12,8,13,4,6,2,5,7/E:(1,2)(3,4)(5,6)(7,8)/rA:13nCCCCNCNCCCCCC/rB:s1;s2;s2;s4;s2;s6;s7;s8;s9;s10;s11;s7s12;/rC:;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C11H24N2 |
All Atoms: | 13 |
Heavy Atoms: | 13 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 7.57274 |
Area: | 342.859 |
Solvation: | -0.998733 |
Coulombic: | -18.3228 |
Bond Count [?]
All: | 13 |
Single: | 13 |
Double: | 0 |
Rotors: | 3 |
Chiral: | 0 |
Rigid Segments: | 3 |
Chemical Properties
Molecular Weight: | 184.322 |
H-Bond Donors: | 2 |
H-Bond Acceptors: | 2 |
XLogP: | 1.56 |
LogP (Chemaxon): | 1.64 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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