Chemical ID: 4351637

c1ccc(cc1)CCC(=O)Nc2cccc(c2)I
Chemical ID:
4351637
Name [?]:
N-(3-iodophenyl)-3-phenyl-propanamide
SMILES [?]:
c1ccc(cc1)CCC(=O)Nc2cccc(c2)I
InChi [?]:
InChI=1/C15H14INO/c16-13-7-4-8-14(11-13)17-15(18)10-9-12-5-2-1-3-6-12/h1-8,11H,9-10H2,(H,17,18)
InChi Info:
AuxInfo=1/1/N:1,2,6,14,3,5,15,13,7,8,17,4,16,12,9,18,11,10/E:(2,3)(5,6)/rA:18nCCCCCCCCCONCCCCCCI/rB:s1;d2;s3;d4;d1s5;s4;s7;s8;d9;s9;s11;s12;d13;s14;d15;d12s16;s16;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H14INO
All Atoms:18
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:9.96898
Area:477.82
Solvation:-1.97651
Coulombic:-22.1754
Bond Count [?]
All:19
Single:12
Double:7
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:351.182
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:4.04
LogP (Chemaxon):4.6

Name Annotations

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Descriptor Annotations

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