Chemical ID: 7154585

CN1CCC(CC1)NC(=O)Cn2c(c(c(n2)C(F)(F)F)Cl)C3CC3
Chemical ID:
7154585
Name [?]:
2-[4-chloro-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(1-methyl-4-piperidyl)-acetamide
SMILES [?]:
CN1CCC(CC1)NC(=O)Cn2c(c(c(n2)C(F)(F)F)Cl)C3CC3
InChi [?]:
InChI=1/C15H20ClF3N4O/c1-22-6-4-10(5-7-22)20-11(24)8-23-13(9-2-3-9)12(16)14(21-23)15(17,18)19/h9-10H,2-8H2,1H3,(H,20,24)
InChi Info:
AuxInfo=1/1/N:1,23,24,4,6,3,7,11,22,5,9,14,13,15,17,21,18,19,20,8,16,2,12,10/E:(2,3)(4,5)(6,7)(17,18,19)/rA:24nCNCCCCCNCOCNCCCNCFFFClCCC/rB:s1;s2;s3;s4;s5;s2s6;s5;s8;d9;s9;s11;s12;d13;s14;s12d15;s15;s17;s17;s17;s14;s13;s22;s22s23;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H20ClF3N4O
All Atoms:44
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:9.67409
Area:531.169
Solvation:-3.60513
Coulombic:-49.2413
Bond Count [?]
All:26
Single:23
Double:3
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:364.794
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:1.99
LogP (Chemaxon):1.4

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Descriptor Annotations

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