Chemical ID: 3965268

CCCCCC(CC(=O)NO)C(=O)NC(C(C)C)C(=O)N1CCCC1CO
Chemical ID:
3965268
Name [?]:
2-(hydroxycarbamoylmethyl)-N-[1-[2-(hydroxymethyl)pyrrolidin-1-yl]carbonyl-2-methyl-propyl]-heptanamide
SMILES [?]:
CCCCCC(CC(=O)NO)C(=O)NC(C(C)C)C(=O)N1CCCC1CO
InChi [?]:
InChI=1/C19H35N3O5/c1-4-5-6-8-14(11-16(24)21-27)18(25)20-17(13(2)3)19(26)22-10-7-9-15(22)12-23/h13-15,17,23,27H,4-12H2,1-3H3,(H,20,25)(H,21,24)
InChi Info:
AuxInfo=1/1/N:1,17,18,2,3,4,23,5,24,22,7,26,16,6,25,8,15,12,19,14,10,21,27,9,13,20,11/E:(2,3)/rA:27cCCCCCCCCONOCONCCCCCONCCCCCO/rB:s1;s2;s3;s4;s5;s6;s7;d8;s8;s10;s6;d12;s12;s14;s15;s16;s16;s15;d19;s19;s21;s22;s23;s21s24;s25;s26;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H35N3O5
All Atoms:27
Heavy Atoms:27
Chiral Atoms:3
ZAP Information [?]
Total:9.38706
Area:632.246
Solvation:-6.41908
Coulombic:-81.1362
Bond Count [?]
All:27
Single:24
Double:3
Rotors:14
Chiral:0
Rigid Segments:11
Chemical Properties
Molecular Weight:385.498
H-Bond Donors:4
H-Bond Acceptors:8
XLogP:1.33
LogP (Chemaxon):0.61

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