Chemical ID: 4682900

CCCCCc1ccc(cc1)NC(=O)C2CCCCC2
Chemical ID:
4682900
Name [?]:
N-(4-pentylphenyl)cyclohexanecarboxamide
SMILES [?]:
CCCCCc1ccc(cc1)NC(=O)C2CCCCC2
InChi [?]:
InChI=1/C18H27NO/c1-2-3-5-8-15-11-13-17(14-12-15)19-18(20)16-9-6-4-7-10-16/h11-14,16H,2-10H2,1H3,(H,19,20)
InChi Info:
AuxInfo=1/1/N:1,2,3,18,4,17,19,5,16,20,7,11,8,10,6,15,9,13,12,14/E:(6,7)(9,10)(11,12)(13,14)/rA:20nCCCCCCCCCCCNCOCCCCCC/rB:s1;s2;s3;s4;s5;s6;d7;s8;d9;d6s10;s9;s12;d13;s13;s15;s16;s17;s18;s15s19;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H27NO
All Atoms:20
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:11.0971
Area:511.453
Solvation:-1.68919
Coulombic:-23.0784
Bond Count [?]
All:21
Single:17
Double:4
Rotors:7
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:273.413
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:5.8
LogP (Chemaxon):5.3

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Descriptor Annotations

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