Chemical ID: 4659282

Cn1c(ccn1)C(=O)Nn2cnnc2
Chemical ID:
4659282
Name [?]:
2-methyl-N-(1,2,4-triazol-4-yl)pyrazole-3-carboxamide
SMILES [?]:
Cn1c(ccn1)C(=O)Nn2cnnc2
InChi [?]:
InChI=1/C7H8N6O/c1-12-6(2-3-10-12)7(14)11-13-4-8-9-5-13/h2-5H,1H3,(H,11,14)
InChi Info:
AuxInfo=1/1/N:1,4,5,11,14,3,7,12,13,6,9,2,10,8/E:(4,5)(8,9)/rA:14nCNCCCNCONNCNNC/rB:s1;s2;d3;s4;s2d5;s3;d7;s7;s9;s10;d11;s12;s10d13;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C7H8N6O
All Atoms:14
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:5.12022
Area:350.315
Solvation:-3.63765
Coulombic:-27.7519
Bond Count [?]
All:15
Single:10
Double:5
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:192.178
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:0.59
LogP (Chemaxon):-2.71

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Descriptor Annotations

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