Chemical ID: 7746357

c1ccc(cc1)C2=NC3(CCNCC3)NC2=O
Chemical ID:
7746357
Name [?]:
None
SMILES [?]:
c1ccc(cc1)C2=NC3(CCNCC3)NC2=O
InChi [?]:
InChI=1/C13H15N3O/c17-12-11(10-4-2-1-3-5-10)15-13(16-12)6-8-14-9-7-13/h1-5,14H,6-9H2,(H,16,17)
InChi Info:
AuxInfo=1/1/N:1,2,6,3,5,10,14,11,13,4,7,16,9,12,8,15,17/E:(2,3)(4,5)(6,7)(8,9)/rA:17nCCCCCCCNCCCNCCNCO/rB:s1;d2;s3;d4;d1s5;s4;d7;s8;s9;s10;s11;s12;s9s13;s9;s7s15;d16;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H15N3O
All Atoms:32
Heavy Atoms:17
Chiral Atoms:None
ZAP Information [?]
Total:8.28832
Area:399.205
Solvation:-1.6918
Coulombic:-38.9132
Bond Count [?]
All:19
Single:14
Double:5
Rotors:1
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:1.09
LogP (Chemaxon):None

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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