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Chemical ID: 5160037
Chemical ID:
5160037
Name [?]:
4-morpholinobenzene-1,3-diamine
SMILES [?]:
c1cc(c(cc1N)N)N2CCOCC2
InChi [?]:
InChI=1/C10H15N3O/c11-8-1-2-10(9(12)7-8)13-3-5-14-6-4-13/h1-2,7H,3-6,11-12H2
InChi Info:
AuxInfo=1/0/N:1,2,10,14,11,13,5,6,4,3,7,8,9,12/E:(3,4)(5,6)/rA:14nCCCCCCNNNCCOCC/rB:s1;d2;s3;d4;d1s5;s6;s4;s3;s9;s10;s11;s12;s9s13;/rC:;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C10H15N3O |
All Atoms: | 14 |
Heavy Atoms: | 14 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 6.18333 |
Area: | 357.587 |
Solvation: | -2.75633 |
Coulombic: | -47.2883 |
Bond Count [?]
All: | 15 |
Single: | 12 |
Double: | 3 |
Rotors: | 1 |
Chiral: | 0 |
Rigid Segments: | 2 |
Chemical Properties
Molecular Weight: | 193.246 |
H-Bond Donors: | 4 |
H-Bond Acceptors: | 4 |
XLogP: | 0.2 |
LogP (Chemaxon): | 0.4 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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