Chemical ID: 4216313

CC(c1ccccc1)NC(=O)c2ccccc2F
Chemical ID:
4216313
Name [?]:
2-fluoro-N-(1-phenylethyl)benzamide
SMILES [?]:
CC(c1ccccc1)NC(=O)c2ccccc2F
InChi [?]:
InChI=1/C15H14FNO/c1-11(12-7-3-2-4-8-12)17-15(18)13-9-5-6-10-14(13)16/h2-11H,1H3,(H,17,18)
InChi Info:
AuxInfo=1/1/N:1,6,5,7,14,15,4,8,13,16,2,3,12,17,10,18,9,11/E:(3,4)(7,8)/rA:18cCCCCCCCCNCOCCCCCCF/rB:s1;s2;s3;d4;s5;d6;d3s7;s2;s9;d10;s10;s12;d13;s14;d15;d12s16;s17;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H14FNO
All Atoms:18
Heavy Atoms:18
Chiral Atoms:1
ZAP Information [?]
Total:7.56064
Area:428.295
Solvation:-3.14673
Coulombic:-27.4438
Bond Count [?]
All:19
Single:12
Double:7
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:243.276
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:3.82
LogP (Chemaxon):3.27

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue