Chemical ID: 6036789

Cc1cc(c(o1)C)C(=O)N(CCC(C)C)CCC(=O)NCC(C)C
Chemical ID:
6036789
Name [?]:
N-[2-(isobutylcarbamoyl)ethyl]-N-isopentyl-2,5-dimethyl-furan-3-carboxamide
SMILES [?]:
Cc1cc(c(o1)C)C(=O)N(CCC(C)C)CCC(=O)NCC(C)C
InChi [?]:
InChI=1/C19H32N2O3/c1-13(2)7-9-21(10-8-18(22)20-12-14(3)4)19(23)17-11-15(5)24-16(17)6/h11,13-14H,7-10,12H2,1-6H3,(H,20,22)
InChi Info:
AuxInfo=1/1/N:14,15,23,24,1,7,12,17,11,16,3,21,13,22,2,5,4,18,8,20,10,19,9,6/E:(1,2)(3,4)/rA:24nCCCCCOCCONCCCCCCCCONCCCC/rB:s1;d2;s3;d4;s2s5;s5;s4;d8;s8;s10;s11;s12;s13;s13;s10;s16;s17;d18;s18;s20;s21;s22;s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H32N2O3
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:11.4995
Area:587.468
Solvation:-3.18725
Coulombic:-44.443
Bond Count [?]
All:24
Single:20
Double:4
Rotors:11
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:336.469
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:2.91
LogP (Chemaxon):2.26

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Descriptor Annotations

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