Chemical ID: 5185751

c1ccc2c(c1)c(c[nH]2)C(=O)C3CCCCC3
Chemical ID:
5185751
Name [?]:
cyclohexyl-(1H-indol-3-yl)methanone
SMILES [?]:
c1ccc2c(c1)c(c[nH]2)C(=O)C3CCCCC3
InChi [?]:
InChI=1/C15H17NO/c17-15(11-6-2-1-3-7-11)13-10-16-14-9-5-4-8-12(13)14/h4-5,8-11,16H,1-3,6-7H2
InChi Info:
AuxInfo=1/0/N:15,14,16,1,2,13,17,6,3,8,12,5,7,4,10,9,11/E:(2,3)(6,7)/rA:17nCCCCCCCCNCOCCCCCC/rB:s1;d2;s3;d4;d1s5;s5;d7;s4s8;s7;d10;s10;s12;s13;s14;s15;s12s16;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H17NO
All Atoms:17
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:8.3449
Area:405.073
Solvation:-1.78193
Coulombic:-20.6576
Bond Count [?]
All:19
Single:14
Double:5
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:227.302
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:3.85
LogP (Chemaxon):3.63

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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