Chemical ID: 7474167

C=CCNC(=O)COc1ccc2ccccc2c1Br
Chemical ID:
7474167
Name [?]:
N-allyl-2-[(1-bromo-2-naphthyl)oxy]acetamide
SMILES [?]:
C=CCNC(=O)COc1ccc2ccccc2c1Br
InChi [?]:
InChI=1/C15H14BrNO2/c1-2-9-17-14(18)10-19-13-8-7-11-5-3-4-6-12(11)15(13)16/h2-8H,1,9-10H2,(H,17,18)
InChi Info:
AuxInfo=1/1/N:1,2,14,15,13,16,11,10,3,7,12,17,9,5,18,19,4,6,8/rA:19nCCCNCOCOCCCCCCCCCCBr/rB:d1;s2;s3;s4;d5;s5;s7;s8;s9;d10;s11;s12;d13;s14;d15;d12s16;d9s17;s18;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H14BrNO2
All Atoms:33
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:7.9109
Area:472.769
Solvation:-3.90831
Coulombic:-31.1956
Bond Count [?]
All:20
Single:13
Double:7
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:320.181
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:3.79
LogP (Chemaxon):3.25

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