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Chemical ID: 4727424
Chemical ID:
4727424
Name [?]:
(2-morpholinophenyl)methanamine
SMILES [?]:
c1ccc(c(c1)CN)N2CCOCC2
InChi [?]:
InChI=1/C11H16N2O/c12-9-10-3-1-2-4-11(10)13-5-7-14-8-6-13/h1-4H,5-9,12H2
InChi Info:
AuxInfo=1/0/N:1,2,6,3,10,14,11,13,7,5,4,8,9,12/E:(5,6)(7,8)/rA:14nCCCCCCCNNCCOCC/rB:s1;d2;s3;d4;d1s5;s5;s7;s4;s9;s10;s11;s12;s9s13;/rC:;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C11H16N2O |
All Atoms: | 14 |
Heavy Atoms: | 14 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 6.21064 |
Area: | 356.792 |
Solvation: | -2.70916 |
Coulombic: | -27.3121 |
Bond Count [?]
All: | 15 |
Single: | 12 |
Double: | 3 |
Rotors: | 2 |
Chiral: | 0 |
Rigid Segments: | 3 |
Chemical Properties
Molecular Weight: | 192.258 |
H-Bond Donors: | 2 |
H-Bond Acceptors: | 3 |
XLogP: | 0.95 |
LogP (Chemaxon): | 1.09 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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