Chemical ID: 4235740

c1cc(ccc1C(=O)N)NC(=O)CCC2CCCCC2
Chemical ID:
4235740
Name [?]:
4-(3-cyclohexylpropanoylamino)benzamide
SMILES [?]:
c1cc(ccc1C(=O)N)NC(=O)CCC2CCCCC2
InChi [?]:
InChI=1/C16H22N2O2/c17-16(20)13-7-9-14(10-8-13)18-15(19)11-6-12-4-2-1-3-5-12/h7-10,12H,1-6,11H2,(H2,17,20)(H,18,19)
InChi Info:
AuxInfo=1/1/N:18,17,19,16,20,14,1,5,2,4,13,15,6,3,11,7,9,10,12,8/E:(2,3)(4,5)(7,8)(9,10)/rA:20nCCCCCCCONNCOCCCCCCCC/rB:s1;d2;s3;d4;d1s5;s6;d7;s7;s3;s10;d11;s11;s13;s14;s15;s16;s17;s18;s15s19;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H22N2O2
All Atoms:20
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:9.55514
Area:491.219
Solvation:-2.72533
Coulombic:-46.9134
Bond Count [?]
All:21
Single:16
Double:5
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:274.358
H-Bond Donors:3
H-Bond Acceptors:4
XLogP:3.43
LogP (Chemaxon):2.46

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