Chemical ID: 4718569

c1cc(cc(c1)F)CN2CCC(CC2)C(=O)NNC(=O)C3CC3
Chemical ID:
4718569
Name [?]:
N'-cyclopropylcarbonyl-1-[(3-fluorophenyl)methyl]piperidine-4-carbohydrazide
SMILES [?]:
c1cc(cc(c1)F)CN2CCC(CC2)C(=O)NNC(=O)C3CC3
InChi [?]:
InChI=1/C17H22FN3O2/c18-15-3-1-2-12(10-15)11-21-8-6-14(7-9-21)17(23)20-19-16(22)13-4-5-13/h1-3,10,13-14H,4-9,11H2,(H,19,22)(H,20,23)
InChi Info:
AuxInfo=1/1/N:1,2,6,22,23,11,13,10,14,4,8,3,21,12,5,19,15,7,18,17,9,20,16/E:(4,5)(6,7)(8,9)/rA:23nCCCCCCFCNCCCCCCONNCOCCC/rB:s1;d2;s3;d4;d1s5;s5;s3;s8;s9;s10;s11;s12;s9s13;s12;d15;s15;s17;s18;d19;s19;s21;s21s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H22FN3O2
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:9.12178
Area:539.498
Solvation:-4.36567
Coulombic:-43.6596
Bond Count [?]
All:25
Single:20
Double:5
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:319.374
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:1.72
LogP (Chemaxon):1.57

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