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Chemical ID: 4956768
Chemical ID:
4956768
Name [?]:
N-(7-acetamido-1,1,3,3,6-pentamethyl-indan-5-yl)acetamide
SMILES [?]:
Cc1c(cc2c(c1NC(=O)C)C(CC2(C)C)(C)C)NC(=O)C
InChi [?]:
InChI=1/C18H26N2O2/c1-10-14(19-11(2)21)8-13-15(16(10)20-12(3)22)18(6,7)9-17(13,4)5/h8H,9H2,1-7H3,(H,19,21)(H,20,22)
InChi Info:
AuxInfo=1/1/N:1,22,11,15,16,17,18,4,13,2,20,9,5,3,6,7,14,12,19,8,21,10/E:(4,5)(6,7)/rA:22nCCCCCCCNCOCCCCCCCCNCOC/rB:s1;s2;d3;s4;d5;d2s6;s7;s8;d9;s9;s6;s12;s5s13;s14;s14;s12;s12;s3;s19;d20;s20;/rC:;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C18H26N2O2 |
All Atoms: | 22 |
Heavy Atoms: | 22 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 9.1921 |
Area: | 482.422 |
Solvation: | -2.86845 |
Coulombic: | -39.0925 |
Bond Count [?]
All: | 23 |
Single: | 18 |
Double: | 5 |
Rotors: | 4 |
Chiral: | 0 |
Rigid Segments: | 3 |
Chemical Properties
Molecular Weight: | 302.411 |
H-Bond Donors: | 2 |
H-Bond Acceptors: | 4 |
XLogP: | 3.27 |
LogP (Chemaxon): | 2.22 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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