Chemical ID: 6660191

C1Cc2c(nn(c2N)CCC#N)C1
Chemical ID:
6660191
Name [?]:
3-(2-amino-3,4-diazabicyclo[3.3.0]octa-1,4-dien-3-yl)propanenitrile
SMILES [?]:
C1Cc2c(nn(c2N)CCC#N)C1
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C9H12N4
All Atoms:13
Heavy Atoms:13
Chiral Atoms:0
ZAP Information [?]
Total:6.84254
Area:359.733
Solvation:-2.1508
Coulombic:-22.2349
Bond Count [?]
All:14
Single:11
Double:2
Rotors:2
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:176.219
H-Bond Donors:2
H-Bond Acceptors:2
XLogP:0.02
LogP (Chemaxon):0.3

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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