Chemical ID: 5788584

CC(C(=O)N1CCCC1C(=O)NCC(=O)O)N
Chemical ID:
5788584
Name [?]:
2-[1-(2-aminopropanoyl)pyrrolidin-2-yl]carbonylaminoacetic acid
SMILES [?]:
CC(C(=O)N1CCCC1C(=O)NCC(=O)O)N
InChi [?]:
InChI=1/C10H17N3O4/c1-6(11)10(17)13-4-2-3-7(13)9(16)12-5-8(14)15/h6-7H,2-5,11H2,1H3,(H,12,16)(H,14,15)
InChi Info:
AuxInfo=1/1/N:1,7,8,6,13,2,9,14,10,3,17,12,5,15,16,11,4/E:(14,15)/rA:17cCCCONCCCCCONCCOON/rB:s1;s2;d3;s3;s5;s6;s7;s5s8;s9;d10;s10;s12;s13;d14;s14;s2;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H17N3O4
All Atoms:17
Heavy Atoms:17
Chiral Atoms:2
ZAP Information [?]
Total:5.81323
Area:425.289
Solvation:-4.819
Coulombic:-74.1207
Bond Count [?]
All:17
Single:14
Double:3
Rotors:6
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:243.26
H-Bond Donors:4
H-Bond Acceptors:7
XLogP:-1.56
LogP (Chemaxon):-5.79

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