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Chemical ID: 5909415
Chemical ID:
5909415
Name [?]:
N-isopropyl-N-[[2-methoxyethyl-[(5-methyl-2-furyl)methyl]carbamoyl]methyl]butanamide
SMILES [?]:
CCCC(=O)N(CC(=O)N(CCOC)Cc1ccc(o1)C)C(C)C
InChi [?]:
InChI=1/C18H30N2O4/c1-6-7-17(21)20(14(2)3)13-18(22)19(10-11-23-5)12-16-9-8-15(4)24-16/h8-9,14H,6-7,10-13H2,1-5H3
InChi Info:
AuxInfo=1/0/N:1,23,24,21,14,2,3,18,17,11,12,15,7,22,19,16,4,8,10,6,5,9,13,20/E:(2,3)/rA:24nCCCCONCCONCCOCCCCCCOCCCC/rB:s1;s2;s3;d4;s4;s6;s7;d8;s8;s10;s11;s12;s13;s10;s15;d16;s17;d18;s16s19;s19;s6;s22;s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C18H30N2O4 |
All Atoms: | 24 |
Heavy Atoms: | 24 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 8.13885 |
Area: | 575.177 |
Solvation: | -6.24058 |
Coulombic: | -44.9413 |
Bond Count [?]
All: | 24 |
Single: | 20 |
Double: | 4 |
Rotors: | 12 |
Chiral: | 0 |
Rigid Segments: | 8 |
Chemical Properties
Molecular Weight: | 338.442 |
H-Bond Donors: | 0 |
H-Bond Acceptors: | 5 |
XLogP: | 1.32 |
LogP (Chemaxon): | 0.99 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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