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Chemical ID: 4953337
Chemical ID:
4953337
Name [?]:
N-ethyl-2-hydroxy-N-(2-hydroxyethyl)propanamide
SMILES [?]:
CCN(CCO)C(=O)C(C)O
InChi [?]:
InChI=1/C7H15NO3/c1-3-8(4-5-9)7(11)6(2)10/h6,9-10H,3-5H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,10,2,4,5,9,7,3,6,11,8/rA:11cCCNCCOCOCCO/rB:s1;s2;s3;s4;s5;s3;d7;s7;s9;s9;/rC:;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C7H15NO3 |
All Atoms: | 11 |
Heavy Atoms: | 11 |
Chiral Atoms: | 1 |
ZAP Information [?]
Total: | 2.87103 |
Area: | 325.706 |
Solvation: | -5.27163 |
Coulombic: | -47.6676 |
Bond Count [?]
All: | 10 |
Single: | 9 |
Double: | 1 |
Rotors: | 5 |
Chiral: | 0 |
Rigid Segments: | 4 |
Chemical Properties
Molecular Weight: | 161.199 |
H-Bond Donors: | 2 |
H-Bond Acceptors: | 4 |
XLogP: | -0.95 |
LogP (Chemaxon): | -0.66 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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