Chemical ID: 7267881

c1cc(c(cc1F)F)NC(=O)CN2CCCC2
Chemical ID:
7267881
Name [?]:
N-(2,4-difluorophenyl)-2-pyrrolidin-1-yl-acetamide
SMILES [?]:
c1cc(c(cc1F)F)NC(=O)CN2CCCC2
InChi [?]:
InChI=1/C12H14F2N2O/c13-9-3-4-11(10(14)7-9)15-12(17)8-16-5-1-2-6-16/h3-4,7H,1-2,5-6,8H2,(H,15,17)
InChi Info:
AuxInfo=1/1/N:15,16,1,2,14,17,5,12,6,4,3,10,7,8,9,13,11/E:(1,2)(5,6)/rA:17nCCCCCCFFNCOCNCCCC/rB:s1;d2;s3;d4;d1s5;s6;s4;s3;s9;d10;s10;s12;s13;s14;s15;s13s16;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H14F2N2O
All Atoms:31
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:6.38581
Area:396.393
Solvation:-3.52401
Coulombic:-32.2928
Bond Count [?]
All:18
Single:14
Double:4
Rotors:4
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:240.249
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:1.63
LogP (Chemaxon):1.19

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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