CCOC(=O)C1CN=C([C@H](C)N)O1
Name: ethyl 2-[(1S)-1-aminoethyl]-4,5-dihydro-1,3-oxazole-5-carboxylate
SMILES: CCOC(=O)C1CN=C([C@H](C)N)O1

Molecular Processing

Molecular formula
C8H14N2O3
Molecular weight
186.21
Exact mass
186.1004
XLogP
-0.31
TPSA
73.91
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
13
Rings
1
Aromatic rings
0
Saturated rings
0
Aliphatic rings
1
Stereo centers
2
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.75
Molar refractivity
47.46

Supplementary Information

InChIKey: DNDOSCDXRSGUNU-ZBHICJROSA-N
Synonyms
DNDOSCDXRSGUNU-ZBHICJROSA-N(s)-2-(1-aminoethyl)-5(r,s)-ethoxycarbonyl-2-oxazoline
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Involved in 2 reactions→

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