Chemical ID: 7196052

c1cc(cc(c1)F)Cn2cc(cn2)N
Chemical ID:
7196052
Name [?]:
1-[(3-fluorophenyl)methyl]pyrazol-4-amine
SMILES [?]:
c1cc(cc(c1)F)Cn2cc(cn2)N
InChi [?]:
InChI=1/C10H10FN3/c11-9-3-1-2-8(4-9)6-14-7-10(12)5-13-14/h1-5,7H,6,12H2
InChi Info:
AuxInfo=1/0/N:1,2,6,4,12,8,10,3,5,11,7,14,13,9/rA:14nCCCCCCFCNCCCNN/rB:s1;d2;s3;d4;d1s5;s5;s3;s8;s9;d10;s11;s9d12;s11;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H10FN3
All Atoms:24
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:6.0793
Area:356.119
Solvation:-2.82366
Coulombic:-24.9485
Bond Count [?]
All:15
Single:10
Double:5
Rotors:2
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:191.205
H-Bond Donors:2
H-Bond Acceptors:1
XLogP:1.98
LogP (Chemaxon):1.45

Name Annotations

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Descriptor Annotations

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