Chemical ID: 5068717

C1CCC(C1)(C(=O)NC2(CCCC2)C(=O)NC3(CCCC3)C(=O)O)N
Chemical ID:
5068717
Name [?]:
1-[1-(1-aminocyclopentyl)carbonylaminocyclopentyl]carbonylaminocyclopentane-1-carboxylic acid
SMILES [?]:
C1CCC(C1)(C(=O)NC2(CCCC2)C(=O)NC3(CCCC3)C(=O)O)N
InChi [?]:
InChI=1/C18H29N3O4/c19-16(7-1-2-8-16)13(22)20-17(9-3-4-10-17)14(23)21-18(15(24)25)11-5-6-12-18/h1-12,19H2,(H,20,22)(H,21,23)(H,24,25)
InChi Info:
AuxInfo=1/1/N:1,2,11,12,19,20,5,3,10,13,18,21,6,14,22,4,9,17,25,8,16,7,15,23,24/E:(1,2)(3,4)(5,6)(7,8)(9,10)(11,12)(24,25)/rA:25nCCCCCCONCCCCCCONCCCCCCOON/rB:s1;s2;s3;s1s4;s4;d6;s6;s8;s9;s10;s11;s9s12;s9;d14;s14;s16;s17;s18;s19;s17s20;s17;d22;s22;s4;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H29N3O4
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:9.05345
Area:517.216
Solvation:-3.87696
Coulombic:-82.6182
Bond Count [?]
All:27
Single:24
Double:3
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:351.441
H-Bond Donors:5
H-Bond Acceptors:7
XLogP:0.2
LogP (Chemaxon):-3.59

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