Chemical ID: 5178084

CC(=O)NC1CCC(CC1)Cc2ccccc2
Chemical ID:
5178084
Name [?]:
N-(4-benzylcyclohexyl)acetamide
SMILES [?]:
CC(=O)NC1CCC(CC1)Cc2ccccc2
InChi [?]:
InChI=1/C15H21NO/c1-12(17)16-15-9-7-14(8-10-15)11-13-5-3-2-4-6-13/h2-6,14-15H,7-11H2,1H3,(H,16,17)
InChi Info:
AuxInfo=1/1/N:1,15,14,16,13,17,7,9,6,10,11,2,12,8,5,4,3/E:(3,4)(5,6)(7,8)(9,10)/rA:17nCCONCCCCCCCCCCCCC/rB:s1;d2;s2;s4;s5;s6;s7;s8;s5s9;s8;s11;s12;d13;s14;d15;d12s16;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H21NO
All Atoms:17
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:8.92515
Area:434.199
Solvation:-1.92983
Coulombic:-22.2264
Bond Count [?]
All:18
Single:14
Double:4
Rotors:4
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:231.333
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:3.49
LogP (Chemaxon):2.74

Name Annotations

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Descriptor Annotations

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