Chemical ID: 5873799

CC(C)CC(=O)N(Cc1ccc(cc1)N(C)C)C2CCCc3c2cccc3
Chemical ID:
5873799
Name [?]:
N-[(4-dimethylaminophenyl)methyl]-3-methyl-N-tetralin-1-yl-butanamide
SMILES [?]:
CC(C)CC(=O)N(Cc1ccc(cc1)N(C)C)C2CCCc3c2cccc3
InChi [?]:
InChI=1/C24H32N2O/c1-18(2)16-24(27)26(17-19-12-14-21(15-13-19)25(3)4)23-11-7-9-20-8-5-6-10-22(20)23/h5-6,8,10,12-15,18,23H,7,9,11,16-17H2,1-4H3
InChi Info:
AuxInfo=1/0/N:1,3,16,17,26,25,20,27,21,24,19,10,14,11,13,4,8,2,9,22,12,23,18,5,15,7,6/E:(1,2)(3,4)(12,13)(14,15)/rA:27cCCCCCONCCCCCCCNCCCCCCCCCCCC/rB:s1;s2;s2;s4;d5;s5;s7;s8;s9;d10;s11;d12;d9s13;s12;s15;s15;s7;s18;s19;s20;s21;s18s22;d23;s24;d25;d22s26;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C24H32N2O
All Atoms:27
Heavy Atoms:27
Chiral Atoms:1
ZAP Information [?]
Total:11.289
Area:568.86
Solvation:-2.93252
Coulombic:-24.555
Bond Count [?]
All:29
Single:22
Double:7
Rotors:7
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:364.524
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:5.69
LogP (Chemaxon):5.48

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Descriptor Annotations

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