Chemical ID: 7157399

CC1(CC(CC(N1)(C)C)NC(=O)c2c(c(nn2C)C(F)(F)F)Cl)C
Chemical ID:
7157399
Name [?]:
4-chloro-2-methyl-N-(2,2,6,6-tetramethyl-4-piperidyl)-5-(trifluoromethyl)pyrazole-3-carboxamide
SMILES [?]:
CC1(CC(CC(N1)(C)C)NC(=O)c2c(c(nn2C)C(F)(F)F)Cl)C
InChi [?]:
InChI=1/C15H22ClF3N4O/c1-13(2)6-8(7-14(3,4)22-13)20-12(24)10-9(16)11(15(17,18)19)21-23(10)5/h8,22H,6-7H2,1-5H3,(H,20,24)
InChi Info:
AuxInfo=1/1/N:1,24,8,9,18,3,5,4,14,13,15,11,2,6,19,23,20,21,22,10,16,7,17,12/E:(1,2,3,4)(6,7)(13,14)(17,18,19)/rA:24nCCCCCCNCCNCOCCCNNCCFFFClC/rB:s1;s2;s3;s4;s5;s2s6;s6;s6;s4;s10;d11;s11;d13;s14;d15;s13s16;s17;s15;s19;s19;s19;s14;s2;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H22ClF3N4O
All Atoms:46
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:10.4873
Area:532.014
Solvation:-2.8131
Coulombic:-54.4066
Bond Count [?]
All:25
Single:22
Double:3
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:366.809
H-Bond Donors:2
H-Bond Acceptors:3
XLogP:3.31
LogP (Chemaxon):1.38

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