Chemical ID: 3930069

c1cc(cc(c1)F)C(=O)Nc2ccc(nc2)NC(=O)C3CC3
Chemical ID:
3930069
Name [?]:
N-(6-cyclopropylcarbonylamino-3-pyridyl)-3-fluoro-benzamide
SMILES [?]:
c1cc(cc(c1)F)C(=O)Nc2ccc(nc2)NC(=O)C3CC3
InChi [?]:
InChI=1/C16H14FN3O2/c17-12-3-1-2-11(8-12)16(22)19-13-6-7-14(18-9-13)20-15(21)10-4-5-10/h1-3,6-10H,4-5H2,(H,19,22)(H,18,20,21)
InChi Info:
AuxInfo=1/1/N:1,2,6,21,22,12,13,4,16,20,3,5,11,14,18,8,7,15,10,17,19,9/E:(4,5)/rA:22nCCCCCCFCONCCCCNCNCOCCC/rB:s1;d2;s3;d4;d1s5;s5;s3;d8;s8;s10;s11;d12;s13;d14;d11s15;s14;s17;d18;s18;s20;s20s21;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H14FN3O2
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:7.58139
Area:498.316
Solvation:-4.8765
Coulombic:-48.0473
Bond Count [?]
All:24
Single:16
Double:8
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:299.3
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:1.67
LogP (Chemaxon):2.64

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Descriptor Annotations

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