Chemical ID: 6009879

Cc1cc(no1)NC(=O)CN(CC2CCCO2)C(=O)CCC3CCCC3
Chemical ID:
6009879
Name [?]:
3-cyclopentyl-N-[(5-methylisoxazol-3-yl)carbamoylmethyl]-N-(tetrahydrofuran-2-ylmethyl)propanamide
SMILES [?]:
Cc1cc(no1)NC(=O)CN(CC2CCCO2)C(=O)CCC3CCCC3
InChi [?]:
InChI=1/C19H29N3O4/c1-14-11-17(21-26-14)20-18(23)13-22(12-16-7-4-10-25-16)19(24)9-8-15-5-2-3-6-15/h11,15-16H,2-10,12-13H2,1H3,(H,20,21,23)
InChi Info:
AuxInfo=1/1/N:1,24,25,15,23,26,14,21,20,16,3,12,10,2,22,13,4,8,18,7,5,11,9,19,17,6/E:(2,3)(5,6)/rA:26cCCCCNONCOCNCCCCCOCOCCCCCCC/rB:s1;d2;s3;d4;s2s5;s4;s7;d8;s8;s10;s11;s12;s13;s14;s15;s13s16;s11;d18;s18;s20;s21;s22;s23;s24;s22s25;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H29N3O4
All Atoms:26
Heavy Atoms:26
Chiral Atoms:1
ZAP Information [?]
Total:9.59377
Area:588.083
Solvation:-5.10831
Coulombic:-47.7165
Bond Count [?]
All:28
Single:24
Double:4
Rotors:10
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:363.451
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:2.92
LogP (Chemaxon):2.03

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