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Chemical ID: 6006616
Chemical ID:
6006616
Name [?]:
N-(2-methoxyethyl)-2,2-dimethyl-N-(p-tolylcarbamoylmethylcarbamoylmethyl)propanamide
SMILES [?]:
Cc1ccc(cc1)NC(=O)CNC(=O)CN(CCOC)C(=O)C(C)(C)C
InChi [?]:
InChI=1/C19H29N3O4/c1-14-6-8-15(9-7-14)21-16(23)12-20-17(24)13-22(10-11-26-5)18(25)19(2,3)4/h6-9H,10-13H2,1-5H3,(H,20,24)(H,21,23)
InChi Info:
AuxInfo=1/1/N:1,24,25,26,20,3,7,4,6,17,18,11,15,2,5,9,13,21,23,12,8,16,10,14,22,19/E:(2,3,4)(6,7)(8,9)/rA:26nCCCCCCCNCOCNCOCNCCOCCOCCCC/rB:s1;s2;d3;s4;d5;d2s6;s5;s8;d9;s9;s11;s12;d13;s13;s15;s16;s17;s18;s19;s16;d21;s21;s23;s23;s23;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C19H29N3O4 |
All Atoms: | 26 |
Heavy Atoms: | 26 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 8.35962 |
Area: | 598.7 |
Solvation: | -6.60788 |
Coulombic: | -63.5648 |
Bond Count [?]
All: | 26 |
Single: | 20 |
Double: | 6 |
Rotors: | 12 |
Chiral: | 0 |
Rigid Segments: | 9 |
Chemical Properties
Molecular Weight: | 363.451 |
H-Bond Donors: | 2 |
H-Bond Acceptors: | 7 |
XLogP: | 0.76 |
LogP (Chemaxon): | 1.62 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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