Chemical ID: 5872809

CCC(C)C(C(=O)NCCC(c1ccccc1)c2ccccc2)N
Chemical ID:
5872809
Name [?]:
2-amino-N-(3,3-diphenylpropyl)-3-methyl-pentanamide
SMILES [?]:
CCC(C)C(C(=O)NCCC(c1ccccc1)c2ccccc2)N
InChi [?]:
InChI=1/C21H28N2O/c1-3-16(2)20(22)21(24)23-15-14-19(17-10-6-4-7-11-17)18-12-8-5-9-13-18/h4-13,16,19-20H,3,14-15,22H2,1-2H3,(H,23,24)
InChi Info:
AuxInfo=1/1/N:1,4,2,15,21,14,16,20,22,13,17,19,23,10,9,3,12,18,11,5,6,24,8,7/E:(4,5)(6,7,8,9)(10,11,12,13)(17,18)/rA:24cCCCCCCONCCCCCCCCCCCCCCCN/rB:s1;s2;s3;s3;s5;d6;s6;s8;s9;s10;s11;s12;d13;s14;d15;d12s16;s11;s18;d19;s20;d21;d18s22;s5;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C21H28N2O
All Atoms:24
Heavy Atoms:24
Chiral Atoms:2
ZAP Information [?]
Total:11.9536
Area:574.977
Solvation:-2.42083
Coulombic:-38.023
Bond Count [?]
All:25
Single:18
Double:7
Rotors:9
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:324.46
H-Bond Donors:3
H-Bond Acceptors:3
XLogP:4.07
LogP (Chemaxon):4.09

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