Chemical ID: 4119844

C1CCN(C1)C(=O)CCCC(=O)O
Chemical ID:
4119844
Name [?]:
5-oxo-5-pyrrolidin-1-yl-pentanoic acid
SMILES [?]:
C1CCN(C1)C(=O)CCCC(=O)O
InChi [?]:
InChI=1/C9H15NO3/c11-8(4-3-5-9(12)13)10-6-1-2-7-10/h1-7H2,(H,12,13)
InChi Info:
AuxInfo=1/1/N:1,2,9,8,10,5,3,6,11,4,7,12,13/E:(1,2)(6,7)(12,13)/rA:13nCCCNCCOCCCCOO/rB:s1;s2;s3;s1s4;s4;d6;s6;s8;s9;s10;d11;s11;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C9H15NO3
All Atoms:13
Heavy Atoms:13
Chiral Atoms:0
ZAP Information [?]
Total:5.99041
Area:371.992
Solvation:-3.30939
Coulombic:-39.8802
Bond Count [?]
All:13
Single:11
Double:2
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:185.22
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:0.09
LogP (Chemaxon):-0.03

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Descriptor Annotations

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