Chemical ID: 4741949

c1c2c(n[nH]c1=O)CCCC2
Chemical ID:
4741949
Name [?]:
5,6,7,8-tetrahydro-2H-cinnolin-3-one
SMILES [?]:
c1c2c(n[nH]c1=O)CCCC2
InChi [?]:
InChI=1/C8H10N2O/c11-8-5-6-3-1-2-4-7(6)9-10-8/h5H,1-4H2,(H,10,11)
InChi Info:
AuxInfo=1/1/N:10,9,11,8,1,2,3,6,4,5,7/rA:11nCCCNNCOCCCC/rB:d1;s2;d3;s4;s1s5;d6;s3;s8;s9;s2s10;/rC:;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C8H10N2O
All Atoms:11
Heavy Atoms:11
Chiral Atoms:0
ZAP Information [?]
Total:5.73951
Area:294.833
Solvation:-1.63131
Coulombic:-19.169
Bond Count [?]
All:12
Single:9
Double:3
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:150.178
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:0.97
LogP (Chemaxon):1.02

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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