Chemical ID: 3992029

CCN1c2ccc(c3c2c(ccc3)C1=O)N
Chemical ID:
3992029
Name [?]:
None
SMILES [?]:
CCN1c2ccc(c3c2c(ccc3)C1=O)N
InChi [?]:
InChI=1/C13H12N2O/c1-2-15-11-7-6-10(14)8-4-3-5-9(12(8)11)13(15)16/h3-7H,2,14H2,1H3
InChi Info:
AuxInfo=1/0/N:1,2,12,13,11,6,5,8,10,7,4,9,14,16,3,15/rA:16nCCNCCCCCCCCCCCON/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s9;d10;s11;s8d12;s3s10;d14;s7;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H12N2O
All Atoms:16
Heavy Atoms:16
Chiral Atoms:0
ZAP Information [?]
Total:7.60751
Area:372.37
Solvation:-1.70175
Coulombic:-34.0685
Bond Count [?]
All:18
Single:12
Double:6
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:212.247
H-Bond Donors:2
H-Bond Acceptors:3
XLogP:1.98
LogP (Chemaxon):1.39

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