Chemical ID: 5768933

CCC(C)NC(=O)Nc1ccccc1F
Chemical ID:
5768933
Name [?]:
3-(2-fluorophenyl)-1-sec-butyl-urea
SMILES [?]:
CCC(C)NC(=O)Nc1ccccc1F
InChi [?]:
InChI=1/C11H15FN2O/c1-3-8(2)13-11(15)14-10-7-5-4-6-9(10)12/h4-8H,3H2,1-2H3,(H2,13,14,15)
InChi Info:
AuxInfo=1/1/N:1,4,2,12,11,13,10,3,14,9,6,15,5,8,7/rA:15cCCCCNCONCCCCCCF/rB:s1;s2;s3;s3;s5;d6;s6;s8;s9;d10;s11;d12;d9s13;s14;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H15FN2O
All Atoms:15
Heavy Atoms:15
Chiral Atoms:1
ZAP Information [?]
Total:7.79257
Area:388.879
Solvation:-1.9294
Coulombic:-40.1051
Bond Count [?]
All:15
Single:11
Double:4
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:210.248
H-Bond Donors:2
H-Bond Acceptors:3
XLogP:2.32
LogP (Chemaxon):2.06

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