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Chemical ID: 6935206
Chemical ID:
6935206
Name [?]:
2-methyl-1-morpholino-pentan-1-one
SMILES [?]:
CCCC(C)C(=O)N1CCOCC1
InChi [?]:
InChI=1/C10H19NO2/c1-3-4-9(2)10(12)11-5-7-13-8-6-11/h9H,3-8H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,5,2,3,9,13,10,12,4,6,8,7,11/E:(5,6)(7,8)/rA:13cCCCCCCONCCOCC/rB:s1;s2;s3;s4;s4;d6;s6;s8;s9;s10;s11;s8s12;/rC:;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C10H19NO2 |
All Atoms: | 32 |
Heavy Atoms: | 13 |
Chiral Atoms: | 1 |
ZAP Information [?]
Total: | 6.24282 |
Area: | 366.295 |
Solvation: | -2.91456 |
Coulombic: | -24.3354 |
Bond Count [?]
All: | 13 |
Single: | 12 |
Double: | 1 |
Rotors: | 4 |
Chiral: | 0 |
Rigid Segments: | 4 |
Chemical Properties
Molecular Weight: | 185.263 |
H-Bond Donors: | 0 |
H-Bond Acceptors: | 3 |
XLogP: | 1.14 |
LogP (Chemaxon): | 1.1 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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