Chemical ID: 7146244

Cc1c(cccc1Cl)Nc2ccc(cn2)N
Chemical ID:
7146244
Name [?]:
N-(3-chloro-2-methyl-phenyl)pyridine-2,5-diamine
SMILES [?]:
Cc1c(cccc1Cl)Nc2ccc(cn2)N
InChi [?]:
InChI=1/C12H12ClN3/c1-8-10(13)3-2-4-11(8)16-12-6-5-9(14)7-15-12/h2-7H,14H2,1H3,(H,15,16)
InChi Info:
AuxInfo=1/1/N:1,5,6,4,12,11,14,2,13,7,3,10,8,16,15,9/rA:16nCCCCCCCClNCCCCCNN/rB:s1;s2;d3;s4;d5;d2s6;s7;s3;s9;s10;d11;s12;d13;d10s14;s13;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H12ClN3
All Atoms:28
Heavy Atoms:16
Chiral Atoms:0
ZAP Information [?]
Total:8.50148
Area:405.057
Solvation:-1.62495
Coulombic:-33.8727
Bond Count [?]
All:17
Single:11
Double:6
Rotors:2
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:233.697
H-Bond Donors:3
H-Bond Acceptors:2
XLogP:2.74
LogP (Chemaxon):2.89

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